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
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Found 4 results

Search term: MLCOBBCNAIBDGU (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
7442239

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H23NO4S2/c1-4-5-10-24-14-8-6-13(7-9-14)11-15-17(21)20(19(25)26-15)16(12(2)3)18(22)23/h6-9,11-12,16H,4-5,10H2,1-3H3,(H,22,23)/b15-11-/t16-/m0/s1
C19H23NO4S2393.52022100
7442249

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H23NO4S2/c1-4-5-10-24-14-8-6-13(7-9-14)11-15-17(21)20(19(25)26-15)16(12(2)3)18(22)23/h6-9,11-12,16H,4-5,10H2,1-3H3,(H,22,23)/b15-11-/t16-/m1/s1
C19H23NO4S2393.52022100
7442238

Charge

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H23NO4S2/c1-4-5-10-24-14-8-6-13(7-9-14)11-15-17(21)20(19(25)26-15)16(12(2)3)18(22)23/h6-9,11-12,16H,4-5,10H2,1-3H3,(H,22,23)/p-1/b15-11-/t16-/m0/s1
C19H22NO4S2392.51281100
7442248

Charge

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H23NO4S2/c1-4-5-10-24-14-8-6-13(7-9-14)11-15-17(21)20(19(25)26-15)16(12(2)3)18(22)23/h6-9,11-12,16H,4-5,10H2,1-3H3,(H,22,23)/p-1/b15-11-/t16-/m1/s1
C19H22NO4S2392.51281100

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