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: PCYQRXYBKKZUSR (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
156343

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H14N2O2/c15-8-13-5-9-4-10(7-13)11-2-1-3-12(16)14(11)6-9/h1-3,8-10H,4-7H2/t9-,10+/m0/s1
C12H14N2O2218.2518252500
512769

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C12H14N2O2/c15-8-13-5-9-4-10(7-13)11-2-1-3-12(16)14(11)6-9/h1-3,8-10H,4-7H2
C12H14N2O2218.2518192300
5036953

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H14N2O2/c15-8-13-5-9-4-10(7-13)11-2-1-3-12(16)14(11)6-9/h1-3,8-10H,4-7H2/t9-,10+/m1/s1
C12H14N2O2218.25185300
77451966

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C12H14N2O2/c15-8-13-5-9-4-10(7-13)11-2-1-3-12(16)14(11)6-9/h1-3,8-10H,4-7H2/t9-,10?/m0/s1
C12H14N2O2218.25183200
114957284

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H14N2O2/c15-8-13-5-9-4-10(7-13)11-2-1-3-12(16)14(11)6-9/h1-3,8-10H,4-7H2/t9-,10-/m1/s1
C12H14N2O2218.25181100
128757585

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H14N2O2/c15-8-13-5-9-4-10(7-13)11-2-1-3-12(16)14(11)6-9/h1-3,8-10H,4-7H2/t9-,10-/m0/s1
C12H14N2O2218.25181100

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