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 3 results

Search term: KTXIKPCVGWAEMA (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
371589

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C17H17NO4/c19-14-4-9-1-2-18-8-11-6-16(21)15(20)5-10(11)3-13(18)12(9)7-17(14)22/h4-7,13,19-22H,1-3,8H2
C17H17NO4299.3212141300
10362671

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C17H17NO4/c19-14-4-9-1-2-18-8-11-6-16(21)15(20)5-10(11)3-13(18)12(9)7-17(14)22/h4-7,13,19-22H,1-3,8H2/p+1
C17H18NO4300.32861100
103883435

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H17NO4/c19-14-4-9-1-2-18-8-11-6-16(21)15(20)5-10(11)3-13(18)12(9)7-17(14)22/h4-7,13,19-22H,1-3,8H2/t13-/m0/s1
C17H17NO4299.32121100

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