2-[4-[(E)-3-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)prop-2-enoyl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(E)-3-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)prop-2-enoyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[(E)-3-(3-bromo-4-ethoxy-5-methoxy-phenyl)prop-2-enoyl]phenoxy]acetonitrile CAS Name: 2-[4-[(E)-3-(3-bromo-4-ethoxy-5-methoxyphenyl)-1-oxoprop-2-enyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[(E)-3-(3-bromo-4-ethoxy-5-methoxyphenyl)prop-2-enoyl]phenoxy]acetonitrile Traditional Name: 2-[4-[(E)-3-(3-bromo-4-ethoxy-5-methoxy-phenyl)acryloyl]phenoxy]acetonitrile Formula: C20H18BrNO4 MolecularWeight: 416.26522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C=CC(=O)C2=CC=C(C=C2)OCC#N)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)/C=C/C(=O)C2=CC=C(C=C2)OCC#N)OC

InChI

InChI=1S/C20H18BrNO4/c1-3-25-20-17(21)12-14(13-19(20)24-2)4-9-18(23)15-5-7-16(8-6-15)26-11-10-22/h4-9,12-13H,3,11H2,1-2H3/b9-4+