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: KMVAXAKRXABEMD (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
24655011

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C17H22N2O3/c1-19-7-6-16-13-9-2-3-11(20)14(13)22-15(16)10(18)4-5-17(16,21)12(19)8-9/h2-3,10,12,15,20-21H,4-8,18H2,1H3/t10-,12-,15+,16+,17-/m1/s1
C17H22N2O3302.36824400
24671999

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C17H22N2O3/c1-19-7-6-16-13-9-2-3-11(20)14(13)22-15(16)10(18)4-5-17(16,21)12(19)8-9/h2-3,10,12,15,20-21H,4-8,18H2,1H3/t10-,12+,15-,16-,17+/m0/s1
C17H22N2O3302.36823300
19984097

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C17H22N2O3/c1-19-7-6-16-13-9-2-3-11(20)14(13)22-15(16)10(18)4-5-17(16,21)12(19)8-9/h2-3,10,12,15,20-21H,4-8,18H2,1H3/t10?,12-,15+,16+,17-/m1/s1
C17H22N2O3302.36823200
118837

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C17H22N2O3/c1-19-7-6-16-13-9-2-3-11(20)14(13)22-15(16)10(18)4-5-17(16,21)12(19)8-9/h2-3,10,12,15,20-21H,4-8,18H2,1H3/t10?,12?,15-,16?,17?/m1/s1
C17H22N2O3302.36822200
8694139

5 of 5 defined stereocentres - 5/5 defined

Non-standard isotope
InChI=1/C17H22N2O3/c1-19-7-6-16-13-9-2-3-11(20)14(13)22-15(16)10(18)4-5-17(16,21)12(19)8-9/h2-3,10,12,15,20-21H,4-8,18H2,1H3/t10-,12-,15+,16+,17-/m1/s1/i4T,5T/t4?,5?,10-,12-,15+,16+,17-
C17H20T2N2O3306.38442200

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