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: GIKPTWKWYXCBEC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8014776

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H12BrNO2/c1-7(15)6-10-8-2-4-17-13(8)11(14)9-3-5-16-12(9)10/h2-5,7H,6,15H2,1H3
C13H12BrNO2294.1439141800
8719838

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H12BrNO2/c1-7(15)6-10-8-2-4-17-13(8)11(14)9-3-5-16-12(9)10/h2-5,7H,6,15H2,1H3/t7-/m1/s1
C13H12BrNO2294.1439101291
8672089

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H12BrNO2/c1-7(15)6-10-8-2-4-17-13(8)11(14)9-3-5-16-12(9)10/h2-5,7H,6,15H2,1H3/t7-/m0/s1
C13H12BrNO2294.14395600
24726642

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H12BrNO2/c1-7(15)6-10-8-2-4-17-13(8)11(14)9-3-5-16-12(9)10/h2-5,7H,6,15H2,1H3/p+1/t7-/m1/s1
C13H13BrNO2295.15131100
34975683

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H12BrNO2/c1-7(15)6-10-8-2-4-17-13(8)11(14)9-3-5-16-12(9)10/h2-5,7H,6,15H2,1H3/p+1/t7-/m0/s1
C13H13BrNO2295.15131100
78362003

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C13H12BrNO2/c1-7(15)6-10-8-2-4-17-13(8)11(14)9-3-5-16-12(9)10/h2-5,7H,6,15H2,1H3/t7-/m1/s1/i1D3,6D2,7D
C13H6D6BrNO2300.18091100

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