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: XIHJEHHSUCQSNW (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3008608

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H16BrNO2/c1-15-7-3-6-12(9-15)17-13(16)10-4-2-5-11(14)8-10/h2,4-5,8,12H,3,6-7,9H2,1H3
C13H16BrNO2298.1756413900
5611514

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H16BrNO2/c1-15-7-3-6-12(9-15)17-13(16)10-4-2-5-11(14)8-10/h2,4-5,8,12H,3,6-7,9H2,1H3/t12-/m0/s1
C13H16BrNO2298.17562100
5611516

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H16BrNO2/c1-15-7-3-6-12(9-15)17-13(16)10-4-2-5-11(14)8-10/h2,4-5,8,12H,3,6-7,9H2,1H3/t12-/m1/s1
C13H16BrNO2298.17562100
5611515

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H16BrNO2/c1-15-7-3-6-12(9-15)17-13(16)10-4-2-5-11(14)8-10/h2,4-5,8,12H,3,6-7,9H2,1H3/p+1/t12-/m1/s1
C13H17BrNO2299.1831100
3571472

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H16BrNO2/c1-15-7-3-6-12(9-15)17-13(16)10-4-2-5-11(14)8-10/h2,4-5,8,12H,3,6-7,9H2,1H3/p+1
C13H17BrNO2299.183581100
5611513

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H16BrNO2/c1-15-7-3-6-12(9-15)17-13(16)10-4-2-5-11(14)8-10/h2,4-5,8,12H,3,6-7,9H2,1H3/p+1/t12-/m0/s1
C13H17BrNO2299.1831100

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