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 5 results

Search term: KHLXTMZRKBVYST (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
322073

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C9H11NO4S/c1-7(9(11)12)10-15(13,14)8-5-3-2-4-6-8/h2-7,10H,1H3,(H,11,12)
C9H11NO4S229.2529493911
5460440

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H11NO4S/c1-7(9(11)12)10-15(13,14)8-5-3-2-4-6-8/h2-7,10H,1H3,(H,11,12)/t7-/m0/s1
C9H11NO4S229.2529412700
5418989

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H11NO4S/c1-7(9(11)12)10-15(13,14)8-5-3-2-4-6-8/h2-7,10H,1H3,(H,11,12)/t7-/m1/s1
C9H11NO4S229.2529191300
5460439

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H11NO4S/c1-7(9(11)12)10-15(13,14)8-5-3-2-4-6-8/h2-7,10H,1H3,(H,11,12)/p-1/t7-/m0/s1
C9H10NO4S228.24551100
5418988

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H11NO4S/c1-7(9(11)12)10-15(13,14)8-5-3-2-4-6-8/h2-7,10H,1H3,(H,11,12)/p-1/t7-/m1/s1
C9H10NO4S228.24551100

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