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: ZYFUNXTYNIYYJI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
251795

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C12H17NO4S/c1-8(2)11(12(14)15)13-18(16,17)10-6-4-9(3)5-7-10/h4-8,11,13H,1-3H3,(H,14,15)
C12H17NO4S271.3327524700
1683181

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H17NO4S/c1-8(2)11(12(14)15)13-18(16,17)10-6-4-9(3)5-7-10/h4-8,11,13H,1-3H3,(H,14,15)/t11-/m0/s1
C12H17NO4S271.3327362500
617962

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H17NO4S/c1-8(2)11(12(14)15)13-18(16,17)10-6-4-9(3)5-7-10/h4-8,11,13H,1-3H3,(H,14,15)/t11-/m1/s1
C12H17NO4S271.3327262200
1683180

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H17NO4S/c1-8(2)11(12(14)15)13-18(16,17)10-6-4-9(3)5-7-10/h4-8,11,13H,1-3H3,(H,14,15)/p-1/t11-/m0/s1
C12H16NO4S270.32531100
4344178

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C12H17NO4S/c1-8(2)11(12(14)15)13-18(16,17)10-6-4-9(3)5-7-10/h4-8,11,13H,1-3H3,(H,14,15)/p-1
C12H16NO4S270.324741100
5299351

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H17NO4S/c1-8(2)11(12(14)15)13-18(16,17)10-6-4-9(3)5-7-10/h4-8,11,13H,1-3H3,(H,14,15)/p-1/t11-/m1/s1
C12H16NO4S270.324741100

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