(E)-3-(4-butoxyphenyl)-N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-2-cyano-prop-2-enamide

Systemtic Name: (E)-3-(4-butoxyphenyl)-N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-2-cyano-prop-2-enamide Openeye Name: (E)-N-(2-benzoyl-4-chloro-phenyl)-3-(4-butoxyphenyl)-2-cyano-prop-2-enamide CAS Name: (E)-N-(2-benzoyl-4-chlorophenyl)-3-(4-butoxyphenyl)-2-cyano-2-propenamide IUPAC Name: (E)-N-(2-benzoyl-4-chlorophenyl)-3-(4-butoxyphenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-N-(2-benzoyl-4-chloro-phenyl)-3-(4-butoxyphenyl)-2-cyano-acrylamide Formula: C27H23ClN2O3 MolecularWeight: 458.93612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C27H23ClN2O3/c1-2-3-15-33-23-12-9-19(10-13-23)16-21(18-29)27(32)30-25-14-11-22(28)17-24(25)26(31)20-7-5-4-6-8-20/h4-14,16-17H,2-3,15H2,1H3,(H,30,32)/b21-16+