2-(3,5-dimethoxyphenyl)-5-[2-(3-ethoxyphenyl)ethyl-methyl-amino]-2-propan-2-yl-pentanenitrile hydrochloride

Systemtic Name: 2-(3,5-dimethoxyphenyl)-5-[2-(3-ethoxyphenyl)ethyl-methyl-amino]-2-propan-2-yl-pentanenitrile hydrochloride Openeye Name: 2-(3,5-dimethoxyphenyl)-5-[2-(3-ethoxyphenyl)ethyl-methyl-amino]-2-isopropyl-pentanenitrile hydrochloride CAS Name: 2-(3,5-dimethoxyphenyl)-5-[2-(3-ethoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile hydrochloride IUPAC Name: 2-(3,5-dimethoxyphenyl)-5-[2-(3-ethoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile hydrochloride Traditional Name: 2-(3,5-dimethoxyphenyl)-2-isopropyl-5-[methyl(2-m-phenetylethyl)amino]valeronitrile hydrochloride Formula: C27H39ClN2O3 MolecularWeight: 475.06316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)CCN(C)CCCC(C#N)(C2=CC(=CC(=C2)OC)OC)C(C)C.Cl

Isomeric SMILES

CCOC1=CC=CC(=C1)CCN(C)CCCC(C#N)(C2=CC(=CC(=C2)OC)OC)C(C)C.Cl

InChI

InChI=1S/C27H38N2O3.ClH/c1-7-32-24-11-8-10-22(16-24)12-15-29(4)14-9-13-27(20-28,21(2)3)23-17-25(30-5)19-26(18-23)31-6;/h8,10-11,16-19,21H,7,9,12-15H2,1-6H3;1H