(E)-3-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-2-cyano-N-(4-ethoxyphenyl)prop-2-enamide

Systemtic Name: (E)-3-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-2-cyano-N-(4-ethoxyphenyl)prop-2-enamide Openeye Name: (E)-3-(3-bromo-5-ethoxy-4-methoxy-phenyl)-2-cyano-N-(4-ethoxyphenyl)prop-2-enamide CAS Name: (E)-3-(3-bromo-5-ethoxy-4-methoxyphenyl)-2-cyano-N-(4-ethoxyphenyl)-2-propenamide IUPAC Name: (E)-3-(3-bromo-5-ethoxy-4-methoxyphenyl)-2-cyano-N-(4-ethoxyphenyl)prop-2-enamide Traditional Name: (E)-3-(3-bromo-5-ethoxy-4-methoxy-phenyl)-2-cyano-N-p-phenetyl-acrylamide Formula: C21H21BrN2O4 MolecularWeight: 445.30644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C(=C2)Br)OC)OCC)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)/C(=C/C2=CC(=C(C(=C2)Br)OC)OCC)/C#N

InChI

InChI=1S/C21H21BrN2O4/c1-4-27-17-8-6-16(7-9-17)24-21(25)15(13-23)10-14-11-18(22)20(26-3)19(12-14)28-5-2/h6-12H,4-5H2,1-3H3,(H,24,25)/b15-10+