(E)-3-(2-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-2-cyano-N-(3-methylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(2-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-2-cyano-N-(3-methylphenyl)prop-2-enamide Openeye Name: (E)-3-(4-benzyloxy-2-bromo-5-methoxy-phenyl)-2-cyano-N-(m-tolyl)prop-2-enamide CAS Name: (E)-3-(2-bromo-5-methoxy-4-phenylmethoxyphenyl)-2-cyano-N-(3-methylphenyl)-2-propenamide IUPAC Name: (E)-3-(2-bromo-5-methoxy-4-phenylmethoxyphenyl)-2-cyano-N-(3-methylphenyl)prop-2-enamide Traditional Name: (E)-3-(4-benzoxy-2-bromo-5-methoxy-phenyl)-2-cyano-N-(m-tolyl)acrylamide Formula: C25H21BrN2O3 MolecularWeight: 477.34984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(=CC2=CC(=C(C=C2Br)OCC3=CC=CC=C3)OC)C#N

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)/C(=C/C2=CC(=C(C=C2Br)OCC3=CC=CC=C3)OC)/C#N

InChI

InChI=1S/C25H21BrN2O3/c1-17-7-6-10-21(11-17)28-25(29)20(15-27)12-19-13-23(30-2)24(14-22(19)26)31-16-18-8-4-3-5-9-18/h3-14H,16H2,1-2H3,(H,28,29)/b20-12+