(E)-N-(3-chlorophenyl)-2-cyano-3-[4-(diethylamino)-2-methoxy-phenyl]prop-2-enamide

Systemtic Name: (E)-N-(3-chlorophenyl)-2-cyano-3-[4-(diethylamino)-2-methoxy-phenyl]prop-2-enamide Openeye Name: (E)-N-(3-chlorophenyl)-2-cyano-3-[4-(diethylamino)-2-methoxy-phenyl]prop-2-enamide CAS Name: (E)-N-(3-chlorophenyl)-2-cyano-3-[4-(diethylamino)-2-methoxyphenyl]-2-propenamide IUPAC Name: (E)-N-(3-chlorophenyl)-2-cyano-3-[4-(diethylamino)-2-methoxyphenyl]prop-2-enamide Traditional Name: (E)-N-(3-chlorophenyl)-2-cyano-3-[4-(diethylamino)-2-methoxy-phenyl]acrylamide Formula: C21H22ClN3O2 MolecularWeight: 383.87128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22ClN3O2/c1-4-25(5-2)19-10-9-15(20(13-19)27-3)11-16(14-23)21(26)24-18-8-6-7-17(22)12-18/h6-13H,4-5H2,1-3H3,(H,24,26)/b16-11+