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: YIRBOOICRQFSOK (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5323519

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H17NO2/c1-9(2)11(13)12(14)15-8-10-6-4-3-5-7-10/h3-7,9,11H,8,13H2,1-2H3/t11-/m0/s1
C12H17NO2207.26888353400
3830498

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C12H17NO2/c1-9(2)11(13)12(14)15-8-10-6-4-3-5-7-10/h3-7,9,11H,8,13H2,1-2H3
C12H17NO2207.2689292300
5676920

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H17NO2/c1-9(2)11(13)12(14)15-8-10-6-4-3-5-7-10/h3-7,9,11H,8,13H2,1-2H3/t11-/m1/s1
C12H17NO2207.268912900
8879053

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C12H17NO2/c1-9(2)11(13)12(14)15-8-10-6-4-3-5-7-10/h3-7,9,11H,8,13H2,1-2H3/t11-/m0/s1/i11+2,12+2
C1014C2H17NO2211.2542200
5323518

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H17NO2/c1-9(2)11(13)12(14)15-8-10-6-4-3-5-7-10/h3-7,9,11H,8,13H2,1-2H3/p+1/t11-/m0/s1
C12H18NO2208.276821100
5676919

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C12H17NO2/c1-9(2)11(13)12(14)15-8-10-6-4-3-5-7-10/h3-7,9,11H,8,13H2,1-2H3/p+1/t11-/m1/s1
C12H18NO2208.27631100

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