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: QKNRTYSNSQAVCD (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
114383

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C18H21NO6/c1-17-9-16(25-19(23)24)18(22)12-5-3-11(20)8-10(12)2-4-14(18)13(17)6-7-15(17)21/h3,5,8,13-14,16,20,22H,2,4,6-7,9H2,1H3/t13-,14-,16-,17-,18?/m0/s1
C18H21NO6347.36245400
109121337

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C18H21NO6/c1-17-9-16(25-19(23)24)18(22)12-5-3-11(20)8-10(12)2-4-14(18)13(17)6-7-15(17)21/h3,5,8,13-14,16,20,22H,2,4,6-7,9H2,1H3/t13-,14-,16?,17-,18?/m0/s1
C18H21NO6347.36242200
58816365

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C18H21NO6/c1-17-9-16(25-19(23)24)18(22)12-5-3-11(20)8-10(12)2-4-14(18)13(17)6-7-15(17)21/h3,5,8,13-14,16,20,22H,2,4,6-7,9H2,1H3/t13-,14-,16-,17?,18?/m0/s1
C18H21NO6347.36241100

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