(E)-3-(3-bromanyl-4,5-diethoxy-phenyl)-N-(5-chloranyl-2-methyl-phenyl)-2-cyano-prop-2-enamide

Systemtic Name: (E)-3-(3-bromanyl-4,5-diethoxy-phenyl)-N-(5-chloranyl-2-methyl-phenyl)-2-cyano-prop-2-enamide Openeye Name: (E)-3-(3-bromo-4,5-diethoxy-phenyl)-N-(5-chloro-2-methyl-phenyl)-2-cyano-prop-2-enamide CAS Name: (E)-3-(3-bromo-4,5-diethoxyphenyl)-N-(5-chloro-2-methylphenyl)-2-cyano-2-propenamide IUPAC Name: (E)-3-(3-bromo-4,5-diethoxyphenyl)-N-(5-chloro-2-methylphenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-3-(3-bromo-4,5-diethoxy-phenyl)-N-(5-chloro-2-methyl-phenyl)-2-cyano-acrylamide Formula: C21H20BrClN2O3 MolecularWeight: 463.7521

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C#N)C(=O)NC2=C(C=CC(=C2)Cl)C)Br)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C(\C#N)/C(=O)NC2=C(C=CC(=C2)Cl)C)Br)OCC

InChI

InChI=1S/C21H20BrClN2O3/c1-4-27-19-10-14(9-17(22)20(19)28-5-2)8-15(12-24)21(26)25-18-11-16(23)7-6-13(18)3/h6-11H,4-5H2,1-3H3,(H,25,26)/b15-8+