2-[4-[(E)-3-(4-methoxy-3-phenylmethoxy-phenyl)prop-2-enoyl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(E)-3-(4-methoxy-3-phenylmethoxy-phenyl)prop-2-enoyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[(E)-3-(3-benzyloxy-4-methoxy-phenyl)prop-2-enoyl]phenoxy]acetonitrile CAS Name: 2-[4-[(E)-3-(4-methoxy-3-phenylmethoxyphenyl)-1-oxoprop-2-enyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[(E)-3-(4-methoxy-3-phenylmethoxyphenyl)prop-2-enoyl]phenoxy]acetonitrile Traditional Name: 2-[4-[(E)-3-(3-benzoxy-4-methoxy-phenyl)acryloyl]phenoxy]acetonitrile Formula: C25H21NO4 MolecularWeight: 399.43854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C2=CC=C(C=C2)OCC#N)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)OCC#N)OCC3=CC=CC=C3

InChI

InChI=1S/C25H21NO4/c1-28-24-14-8-19(17-25(24)30-18-20-5-3-2-4-6-20)7-13-23(27)21-9-11-22(12-10-21)29-16-15-26/h2-14,17H,16,18H2,1H3/b13-7+