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

Systemtic Name: N-[2,5-bis(chloranyl)phenyl]-3-(4-butoxy-3-methoxy-phenyl)-2-cyano-prop-2-enamide Openeye Name: 3-(4-butoxy-3-methoxy-phenyl)-2-cyano-N-(2,5-dichlorophenyl)prop-2-enamide CAS Name: 3-(4-butoxy-3-methoxyphenyl)-2-cyano-N-(2,5-dichlorophenyl)-2-propenamide IUPAC Name: 3-(4-butoxy-3-methoxyphenyl)-2-cyano-N-(2,5-dichlorophenyl)prop-2-enamide Traditional Name: 3-(4-butoxy-3-methoxy-phenyl)-2-cyano-N-(2,5-dichlorophenyl)acrylamide Formula: C21H20Cl2N2O3 MolecularWeight: 419.3011

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20Cl2N2O3/c1-3-4-9-28-19-8-5-14(11-20(19)27-2)10-15(13-24)21(26)25-18-12-16(22)6-7-17(18)23/h5-8,10-12H,3-4,9H2,1-2H3,(H,25,26)