4-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]benzenecarbonitrile Openeye Name: 4-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]benzonitrile CAS Name: 4-[(E)-3-(3,4-dimethoxyphenyl)-1-oxoprop-2-enyl]benzonitrile IUPAC Name: 4-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]benzonitrile Traditional Name: 4-[(E)-3-(3,4-dimethoxyphenyl)acryloyl]benzonitrile Formula: C18H15NO3 MolecularWeight: 293.3166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C2=CC=C(C=C2)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)C#N)OC

InChI

InChI=1S/C18H15NO3/c1-21-17-10-6-13(11-18(17)22-2)5-9-16(20)15-7-3-14(12-19)4-8-15/h3-11H,1-2H3/b9-5+