(E)-3-[4-[(3-bromophenyl)methoxy]-3-methoxy-phenyl]-2-cyano-N-(4-ethanoylphenyl)prop-2-enamide

Systemtic Name: (E)-3-[4-[(3-bromophenyl)methoxy]-3-methoxy-phenyl]-2-cyano-N-(4-ethanoylphenyl)prop-2-enamide Openeye Name: (E)-N-(4-acetylphenyl)-3-[4-[(3-bromophenyl)methoxy]-3-methoxy-phenyl]-2-cyano-prop-2-enamide CAS Name: (E)-N-(4-acetylphenyl)-3-[4-[(3-bromophenyl)methoxy]-3-methoxyphenyl]-2-cyano-2-propenamide IUPAC Name: (E)-N-(4-acetylphenyl)-3-[4-[(3-bromophenyl)methoxy]-3-methoxyphenyl]-2-cyanoprop-2-enamide Traditional Name: (E)-N-(4-acetylphenyl)-3-[4-(3-bromobenzyl)oxy-3-methoxy-phenyl]-2-cyano-acrylamide Formula: C26H21BrN2O4 MolecularWeight: 505.35994

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC(=CC=C3)Br)OC)C#N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)/C(=C/C2=CC(=C(C=C2)OCC3=CC(=CC=C3)Br)OC)/C#N

InChI

InChI=1S/C26H21BrN2O4/c1-17(30)20-7-9-23(10-8-20)29-26(31)21(15-28)12-18-6-11-24(25(14-18)32-2)33-16-19-4-3-5-22(27)13-19/h3-14H,16H2,1-2H3,(H,29,31)/b21-12+