2-(3,4-dimethoxyphenyl)-5-[(1-phenethylpiperidin-4-yl)amino]-2-propan-2-yl-pentanenitrile hydrochloride

Systemtic Name: 2-(3,4-dimethoxyphenyl)-5-[(1-phenethylpiperidin-4-yl)amino]-2-propan-2-yl-pentanenitrile hydrochloride Openeye Name: 2-(3,4-dimethoxyphenyl)-2-isopropyl-5-[(1-phenethyl-4-piperidyl)amino]pentanenitrile hydrochloride CAS Name: 2-(3,4-dimethoxyphenyl)-5-[(1-phenethyl-4-piperidinyl)amino]-2-propan-2-ylpentanenitrile hydrochloride IUPAC Name: 2-(3,4-dimethoxyphenyl)-5-[(1-phenethylpiperidin-4-yl)amino]-2-propan-2-ylpentanenitrile hydrochloride Traditional Name: 2-(3,4-dimethoxyphenyl)-2-isopropyl-5-[(1-phenethyl-4-piperidyl)amino]valeronitrile hydrochloride Formula: C29H42ClN3O2 MolecularWeight: 500.11568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCNC1CCN(CC1)CCC2=CC=CC=C2)(C#N)C3=CC(=C(C=C3)OC)OC.Cl

Isomeric SMILES

CC(C)C(CCCNC1CCN(CC1)CCC2=CC=CC=C2)(C#N)C3=CC(=C(C=C3)OC)OC.Cl

InChI

InChI=1S/C29H41N3O2.ClH/c1-23(2)29(22-30,25-11-12-27(33-3)28(21-25)34-4)16-8-17-31-26-14-19-32(20-15-26)18-13-24-9-6-5-7-10-24;/h5-7,9-12,21,23,26,31H,8,13-20H2,1-4H3;1H