2-[3-(4-chlorophenyl)-1-(3,4-dimethoxyphenyl)-3-oxidanylidene-propyl]propanedinitrile

Systemtic Name: 2-[3-(4-chlorophenyl)-1-(3,4-dimethoxyphenyl)-3-oxidanylidene-propyl]propanedinitrile Openeye Name: 2-[3-(4-chlorophenyl)-1-(3,4-dimethoxyphenyl)-3-oxo-propyl]propanedinitrile CAS Name: 2-[3-(4-chlorophenyl)-1-(3,4-dimethoxyphenyl)-3-oxopropyl]propanedinitrile IUPAC Name: 2-[3-(4-chlorophenyl)-1-(3,4-dimethoxyphenyl)-3-oxopropyl]propanedinitrile Traditional Name: 2-[3-(4-chlorophenyl)-1-(3,4-dimethoxyphenyl)-3-keto-propyl]malononitrile Formula: C20H17ClN2O3 MolecularWeight: 368.81358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC(=O)C2=CC=C(C=C2)Cl)C(C#N)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC(=O)C2=CC=C(C=C2)Cl)C(C#N)C#N)OC

InChI

InChI=1S/C20H17ClN2O3/c1-25-19-8-5-14(9-20(19)26-2)17(15(11-22)12-23)10-18(24)13-3-6-16(21)7-4-13/h3-9,15,17H,10H2,1-2H3