2-(4-chlorophenyl)-2-cyclopropyl-5-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]pentanenitrile

Systemtic Name: 2-(4-chlorophenyl)-2-cyclopropyl-5-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]pentanenitrile Openeye Name: 2-(4-chlorophenyl)-2-cyclopropyl-5-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]pentanenitrile CAS Name: 2-(4-chlorophenyl)-2-cyclopropyl-5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]pentanenitrile IUPAC Name: 2-(4-chlorophenyl)-2-cyclopropyl-5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]pentanenitrile Traditional Name: 2-(4-chlorophenyl)-2-cyclopropyl-5-[homoveratryl(methyl)amino]valeronitrile Formula: C25H31ClN2O2 MolecularWeight: 426.97884

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(C#N)(C1CC1)C2=CC=C(C=C2)Cl)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN(CCCC(C#N)(C1CC1)C2=CC=C(C=C2)Cl)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C25H31ClN2O2/c1-28(16-13-19-5-12-23(29-2)24(17-19)30-3)15-4-14-25(18-27,20-6-7-20)21-8-10-22(26)11-9-21/h5,8-12,17,20H,4,6-7,13-16H2,1-3H3