(E)-3-(4-butoxyphenyl)-N-(3-chloranyl-4-methyl-phenyl)-2-cyano-prop-2-enamide

Systemtic Name: (E)-3-(4-butoxyphenyl)-N-(3-chloranyl-4-methyl-phenyl)-2-cyano-prop-2-enamide Openeye Name: (E)-3-(4-butoxyphenyl)-N-(3-chloro-4-methyl-phenyl)-2-cyano-prop-2-enamide CAS Name: (E)-3-(4-butoxyphenyl)-N-(3-chloro-4-methylphenyl)-2-cyano-2-propenamide IUPAC Name: (E)-3-(4-butoxyphenyl)-N-(3-chloro-4-methylphenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-3-(4-butoxyphenyl)-N-(3-chloro-4-methyl-phenyl)-2-cyano-acrylamide Formula: C21H21ClN2O2 MolecularWeight: 368.85664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=CC(=C(C=C2)C)Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC(=C(C=C2)C)Cl

InChI

InChI=1S/C21H21ClN2O2/c1-3-4-11-26-19-9-6-16(7-10-19)12-17(14-23)21(25)24-18-8-5-15(2)20(22)13-18/h5-10,12-13H,3-4,11H2,1-2H3,(H,24,25)/b17-12+