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 6 results

Search term: IDQGBMNAMAIMHE (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3845901

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C19H28N2O4S/c1-3-25-19(23)17-14-5-4-13(2)12-15(14)26-18(17)20-16(22)6-7-21-8-10-24-11-9-21/h13H,3-12H2,1-2H3,(H,20,22)
C19H28N2O4S380.5016271600
1003061

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H28N2O4S/c1-3-25-19(23)17-14-5-4-13(2)12-15(14)26-18(17)20-16(22)6-7-21-8-10-24-11-9-21/h13H,3-12H2,1-2H3,(H,20,22)/t13-/m0/s1
C19H28N2O4S380.50162100
1003062

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H28N2O4S/c1-3-25-19(23)17-14-5-4-13(2)12-15(14)26-18(17)20-16(22)6-7-21-8-10-24-11-9-21/h13H,3-12H2,1-2H3,(H,20,22)/t13-/m1/s1
C19H28N2O4S380.50162100
4239983

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C19H28N2O4S/c1-3-25-19(23)17-14-5-4-13(2)12-15(14)26-18(17)20-16(22)6-7-21-8-10-24-11-9-21/h13H,3-12H2,1-2H3,(H,20,22)/p+1
C19H29N2O4S381.509561100
5343880

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H28N2O4S/c1-3-25-19(23)17-14-5-4-13(2)12-15(14)26-18(17)20-16(22)6-7-21-8-10-24-11-9-21/h13H,3-12H2,1-2H3,(H,20,22)/p+1/t13-/m0/s1
C19H29N2O4S381.5091100
5343881

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H28N2O4S/c1-3-25-19(23)17-14-5-4-13(2)12-15(14)26-18(17)20-16(22)6-7-21-8-10-24-11-9-21/h13H,3-12H2,1-2H3,(H,20,22)/p+1/t13-/m1/s1
C19H29N2O4S381.5091100

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