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

Systemtic Name: 3-[3,5-bis(chloranyl)-4-octoxy-phenyl]-2-cyano-N-(phenylmethyl)prop-2-enamide Openeye Name: N-benzyl-2-cyano-3-(3,5-dichloro-4-octoxy-phenyl)prop-2-enamide CAS Name: 2-cyano-3-(3,5-dichloro-4-octoxyphenyl)-N-(phenylmethyl)-2-propenamide IUPAC Name: N-benzyl-2-cyano-3-(3,5-dichloro-4-octoxyphenyl)prop-2-enamide Traditional Name: N-benzyl-2-cyano-3-(3,5-dichloro-4-octoxy-phenyl)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)NCC2=CC=CC=C2)Cl

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1Cl)C=C(C#N)C(=O)NCC2=CC=CC=C2)Cl

InChI

InChI=1S/C25H28Cl2N2O2/c1-2-3-4-5-6-10-13-31-24-22(26)15-20(16-23(24)27)14-21(17-28)25(30)29-18-19-11-8-7-9-12-19/h7-9,11-12,14-16H,2-6,10,13,18H2,1H3,(H,29,30)