(E)-3-(2-bromanyl-4,5-dimethoxy-phenyl)-2-(2-methylphenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(2-bromanyl-4,5-dimethoxy-phenyl)-2-(2-methylphenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(2-bromo-4,5-dimethoxy-phenyl)-2-(2-methylbenzoyl)prop-2-enenitrile CAS Name: (E)-3-(2-bromo-4,5-dimethoxyphenyl)-2-[(2-methylphenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(2-bromo-4,5-dimethoxyphenyl)-2-(2-methylbenzoyl)prop-2-enenitrile Traditional Name: (E)-3-(2-bromo-4,5-dimethoxy-phenyl)-2-o-toluoyl-acrylonitrile Formula: C19H16BrNO3 MolecularWeight: 386.23924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C(=CC2=CC(=C(C=C2Br)OC)OC)C#N

Isomeric SMILES

CC1=CC=CC=C1C(=O)/C(=C/C2=CC(=C(C=C2Br)OC)OC)/C#N

InChI

InChI=1S/C19H16BrNO3/c1-12-6-4-5-7-15(12)19(22)14(11-21)8-13-9-17(23-2)18(24-3)10-16(13)20/h4-10H,1-3H3/b14-8+