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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(CCCN(C)CCC2=CC(=CC(=C2)OC)OC)(C#N)C(C)C.Cl

Isomeric SMILES

CCOC1=CC=CC(=C1)C(CCCN(C)CCC2=CC(=CC(=C2)OC)OC)(C#N)C(C)C.Cl

InChI

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