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

Systemtic Name: (E)-3-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)-2-cyano-N-(3-ethanoylphenyl)prop-2-enamide Openeye Name: (E)-N-(3-acetylphenyl)-3-(3-bromo-4-ethoxy-5-methoxy-phenyl)-2-cyano-prop-2-enamide CAS Name: (E)-N-(3-acetylphenyl)-3-(3-bromo-4-ethoxy-5-methoxyphenyl)-2-cyano-2-propenamide IUPAC Name: (E)-N-(3-acetylphenyl)-3-(3-bromo-4-ethoxy-5-methoxyphenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-N-(3-acetylphenyl)-3-(3-bromo-4-ethoxy-5-methoxy-phenyl)-2-cyano-acrylamide Formula: C21H19BrN2O4 MolecularWeight: 443.29056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C=C(C#N)C(=O)NC2=CC=CC(=C2)C(=O)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)/C=C(\C#N)/C(=O)NC2=CC=CC(=C2)C(=O)C)OC

InChI

InChI=1S/C21H19BrN2O4/c1-4-28-20-18(22)9-14(10-19(20)27-3)8-16(12-23)21(26)24-17-7-5-6-15(11-17)13(2)25/h5-11H,4H2,1-3H3,(H,24,26)/b16-8+