2-[4-[(E)-3-(3,4-dimethoxyphenyl)-3-oxidanylidene-prop-1-enyl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(E)-3-(3,4-dimethoxyphenyl)-3-oxidanylidene-prop-1-enyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[(E)-3-(3,4-dimethoxyphenyl)-3-oxo-prop-1-enyl]phenoxy]acetonitrile CAS Name: 2-[4-[(E)-3-(3,4-dimethoxyphenyl)-3-oxoprop-1-enyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[(E)-3-(3,4-dimethoxyphenyl)-3-oxoprop-1-enyl]phenoxy]acetonitrile Traditional Name: 2-[4-[(E)-3-(3,4-dimethoxyphenyl)-3-keto-prop-1-enyl]phenoxy]acetonitrile Formula: C19H17NO4 MolecularWeight: 323.34258

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C=CC2=CC=C(C=C2)OCC#N)OC

Isomeric SMILES

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

InChI

InChI=1S/C19H17NO4/c1-22-18-10-6-15(13-19(18)23-2)17(21)9-5-14-3-7-16(8-4-14)24-12-11-20/h3-10,13H,12H2,1-2H3/b9-5+