3-[3,5-bis(chloranyl)-4-octoxy-phenyl]-2-cyano-N-(3-methylphenyl)prop-2-enamide

Systemtic Name: 3-[3,5-bis(chloranyl)-4-octoxy-phenyl]-2-cyano-N-(3-methylphenyl)prop-2-enamide Openeye Name: 2-cyano-3-(3,5-dichloro-4-octoxy-phenyl)-N-(m-tolyl)prop-2-enamide CAS Name: 2-cyano-3-(3,5-dichloro-4-octoxyphenyl)-N-(3-methylphenyl)-2-propenamide IUPAC Name: 2-cyano-3-(3,5-dichloro-4-octoxyphenyl)-N-(3-methylphenyl)prop-2-enamide Traditional Name: 2-cyano-3-(3,5-dichloro-4-octoxy-phenyl)-N-(m-tolyl)acrylamide Formula: C25H28Cl2N2O2 MolecularWeight: 459.40802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1Cl)C=C(C#N)C(=O)NC2=CC=CC(=C2)C)Cl

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1Cl)C=C(C#N)C(=O)NC2=CC=CC(=C2)C)Cl

InChI

InChI=1S/C25H28Cl2N2O2/c1-3-4-5-6-7-8-12-31-24-22(26)15-19(16-23(24)27)14-20(17-28)25(30)29-21-11-9-10-18(2)13-21/h9-11,13-16H,3-8,12H2,1-2H3,(H,29,30)