Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 7 results

Search term: BWFBYOSUPBPHBK (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
1007940

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C23H25ClN2O3/c1-14-5-6-15(2)18(13-14)21(27)19-20(16-7-9-17(24)10-8-16)26(12-11-25(3)4)23(29)22(19)28/h5-10,13,20,27H,11-12H2,1-4H3/t20-/m0/s1
C23H25ClN2O3412.90922100
1007941

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C23H25ClN2O3/c1-14-5-6-15(2)18(13-14)21(27)19-20(16-7-9-17(24)10-8-16)26(12-11-25(3)4)23(29)22(19)28/h5-10,13,20,27H,11-12H2,1-4H3/t20-/m1/s1
C23H25ClN2O3412.90922100
2659698

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C23H25ClN2O3/c1-14-5-6-15(2)18(13-14)21(27)19-20(16-7-9-17(24)10-8-16)26(12-11-25(3)4)23(29)22(19)28/h5-10,13,20,27H,11-12H2,1-4H3
C23H25ClN2O3412.90922100
68028667

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C23H25ClN2O3/c1-14-5-6-15(2)18(13-14)21(27)19-20(16-7-9-17(24)10-8-16)26(12-11-25(3)4)23(29)22(19)28/h5-10,13,20,27H,11-12H2,1-4H3/b21-19+
C23H25ClN2O3412.90922200
3329098

Charge

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C23H25ClN2O3/c1-14-5-6-15(2)18(13-14)21(27)19-20(16-7-9-17(24)10-8-16)26(12-11-25(3)4)23(29)22(19)28/h5-10,13,20,27H,11-12H2,1-4H3/p+1
C23H26ClN2O3413.91661100
5344205

Charge

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C23H25ClN2O3/c1-14-5-6-15(2)18(13-14)21(27)19-20(16-7-9-17(24)10-8-16)26(12-11-25(3)4)23(29)22(19)28/h5-10,13,20,27H,11-12H2,1-4H3/p+1/t20-/m1/s1
C23H26ClN2O3413.91661100
5344206

Charge

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C23H25ClN2O3/c1-14-5-6-15(2)18(13-14)21(27)19-20(16-7-9-17(24)10-8-16)26(12-11-25(3)4)23(29)22(19)28/h5-10,13,20,27H,11-12H2,1-4H3/p+1/t20-/m0/s1
C23H26ClN2O3413.91661100

Advertisement