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: GCWLCINIEOOJGU (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2201600

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H17NO4S/c1-10-5-7-11(8-6-10)19(17,18)14-9-3-2-4-12(14)13(15)16/h5-8,12H,2-4,9H2,1H3,(H,15,16)
C13H17NO4S283.34338634600
615985

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H17NO4S/c1-10-5-7-11(8-6-10)19(17,18)14-9-3-2-4-12(14)13(15)16/h5-8,12H,2-4,9H2,1H3,(H,15,16)/t12-/m0/s1
C13H17NO4S283.343412800
1553844

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H17NO4S/c1-10-5-7-11(8-6-10)19(17,18)14-9-3-2-4-12(14)13(15)16/h5-8,12H,2-4,9H2,1H3,(H,15,16)/t12-/m1/s1
C13H17NO4S283.34346500
1553843

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H17NO4S/c1-10-5-7-11(8-6-10)19(17,18)14-9-3-2-4-12(14)13(15)16/h5-8,12H,2-4,9H2,1H3,(H,15,16)/p-1/t12-/m1/s1
C13H16NO4S282.3361100
2574596

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H17NO4S/c1-10-5-7-11(8-6-10)19(17,18)14-9-3-2-4-12(14)13(15)16/h5-8,12H,2-4,9H2,1H3,(H,15,16)/p-1
C13H16NO4S282.3361100
5381558

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H17NO4S/c1-10-5-7-11(8-6-10)19(17,18)14-9-3-2-4-12(14)13(15)16/h5-8,12H,2-4,9H2,1H3,(H,15,16)/p-1/t12-/m0/s1
C13H16NO4S282.3361100

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