3-[3,4-bis(oxidanyl)phenyl]-3-oxidanylidene-propanenitrile

Systemtic Name: 3-[3,4-bis(oxidanyl)phenyl]-3-oxidanylidene-propanenitrile Openeye Name: 3-(3,4-dihydroxyphenyl)-3-oxo-propanenitrile CAS Name: 3-(3,4-dihydroxyphenyl)-3-oxopropanenitrile IUPAC Name: 3-(3,4-dihydroxyphenyl)-3-oxopropanenitrile Traditional Name: 3-(3,4-dihydroxyphenyl)-3-keto-propionitrile Formula: C9H7NO3 MolecularWeight: 177.15678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)CC#N)O)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)CC#N)O)O

InChI

InChI=1S/C9H7NO3/c10-4-3-7(11)6-1-2-8(12)9(13)5-6/h1-2,5,12-13H,3H2