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: FUQXNUHEEQWCAN (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2256375

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C9H13BrN2O2/c1-5(4-8(13)14)12-7(3)9(10)6(2)11-12/h5H,4H2,1-3H3,(H,13,14)
C9H13BrN2O2261.11572483100
934818

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H13BrN2O2/c1-5(4-8(13)14)12-7(3)9(10)6(2)11-12/h5H,4H2,1-3H3,(H,13,14)/t5-/m0/s1
C9H13BrN2O2261.11572100
934819

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H13BrN2O2/c1-5(4-8(13)14)12-7(3)9(10)6(2)11-12/h5H,4H2,1-3H3,(H,13,14)/t5-/m1/s1
C9H13BrN2O2261.11572100
5337365

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H13BrN2O2/c1-5(4-8(13)14)12-7(3)9(10)6(2)11-12/h5H,4H2,1-3H3,(H,13,14)/p-1/t5-/m0/s1
C9H12BrN2O2260.10831100
5337366

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H13BrN2O2/c1-5(4-8(13)14)12-7(3)9(10)6(2)11-12/h5H,4H2,1-3H3,(H,13,14)/p-1/t5-/m1/s1
C9H12BrN2O2260.10831100

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