2-(4-chlorophenyl)-4-(4-methoxyphenyl)-2-(pyridin-3-ylmethyl)butanenitrile

Systemtic Name: 2-(4-chlorophenyl)-4-(4-methoxyphenyl)-2-(pyridin-3-ylmethyl)butanenitrile Openeye Name: 2-(4-chlorophenyl)-4-(4-methoxyphenyl)-2-(3-pyridylmethyl)butanenitrile CAS Name: 2-(4-chlorophenyl)-4-(4-methoxyphenyl)-2-(3-pyridinylmethyl)butanenitrile IUPAC Name: 2-(4-chlorophenyl)-4-(4-methoxyphenyl)-2-(pyridin-3-ylmethyl)butanenitrile Traditional Name: 2-(4-chlorophenyl)-4-(4-methoxyphenyl)-2-(3-pyridylmethyl)butyronitrile Formula: C23H21ClN2O MolecularWeight: 376.87864

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(CC2=CN=CC=C2)(C#N)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)CCC(CC2=CN=CC=C2)(C#N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H21ClN2O/c1-27-22-10-4-18(5-11-22)12-13-23(17-25,15-19-3-2-14-26-16-19)20-6-8-21(24)9-7-20/h2-11,14,16H,12-13,15H2,1H3