4-[(E)-3-(2-bromanyl-4,5-dimethoxy-phenyl)prop-2-enoyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-3-(2-bromanyl-4,5-dimethoxy-phenyl)prop-2-enoyl]benzenecarbonitrile Openeye Name: 4-[(E)-3-(2-bromo-4,5-dimethoxy-phenyl)prop-2-enoyl]benzonitrile CAS Name: 4-[(E)-3-(2-bromo-4,5-dimethoxyphenyl)-1-oxoprop-2-enyl]benzonitrile IUPAC Name: 4-[(E)-3-(2-bromo-4,5-dimethoxyphenyl)prop-2-enoyl]benzonitrile Traditional Name: 4-[(E)-3-(2-bromo-4,5-dimethoxy-phenyl)acryloyl]benzonitrile Formula: C18H14BrNO3 MolecularWeight: 372.21266

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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)Br)OC

Isomeric SMILES

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

InChI

InChI=1S/C18H14BrNO3/c1-22-17-9-14(15(19)10-18(17)23-2)7-8-16(21)13-5-3-12(11-20)4-6-13/h3-10H,1-2H3/b8-7+