(E)-3-[3,4-bis(oxidanyl)phenyl]-2-(4-methylphenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[3,4-bis(oxidanyl)phenyl]-2-(4-methylphenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(3,4-dihydroxyphenyl)-2-(4-methylbenzoyl)prop-2-enenitrile CAS Name: (E)-3-(3,4-dihydroxyphenyl)-2-[(4-methylphenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3,4-dihydroxyphenyl)-2-(4-methylbenzoyl)prop-2-enenitrile Traditional Name: (E)-3-(3,4-dihydroxyphenyl)-2-p-toluoyl-acrylonitrile Formula: C17H13NO3 MolecularWeight: 279.29002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(=CC2=CC(=C(C=C2)O)O)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)/C(=C/C2=CC(=C(C=C2)O)O)/C#N

InChI

InChI=1S/C17H13NO3/c1-11-2-5-13(6-3-11)17(21)14(10-18)8-12-4-7-15(19)16(20)9-12/h2-9,19-20H,1H3/b14-8+