[(E)-3-phenylprop-2-enyl] (Z)-3-[3,4-bis(oxidanyl)phenyl]-3-cyano-prop-2-enoate

Systemtic Name: [(E)-3-phenylprop-2-enyl] (Z)-3-[3,4-bis(oxidanyl)phenyl]-3-cyano-prop-2-enoate Openeye Name: [(E)-cinnamyl] (Z)-3-cyano-3-(3,4-dihydroxyphenyl)prop-2-enoate CAS Name: (Z)-3-cyano-3-(3,4-dihydroxyphenyl)-2-propenoic acid [(E)-3-phenylprop-2-enyl] ester IUPAC Name: [(E)-3-phenylprop-2-enyl] (Z)-3-cyano-3-(3,4-dihydroxyphenyl)prop-2-enoate Traditional Name: (Z)-3-cyano-3-(3,4-dihydroxyphenyl)acrylic acid [(E)-cinnamyl] ester Formula: C19H15NO4 MolecularWeight: 321.3267

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCOC(=O)C=C(C#N)C2=CC(=C(C=C2)O)O

Isomeric SMILES

C1=CC=C(C=C1)/C=C/COC(=O)/C=C(\C#N)/C2=CC(=C(C=C2)O)O

InChI

InChI=1S/C19H15NO4/c20-13-16(15-8-9-17(21)18(22)11-15)12-19(23)24-10-4-7-14-5-2-1-3-6-14/h1-9,11-12,21-22H,10H2/b7-4+,16-12+