2-(3,4-dimethoxyphenyl)-3-[2-(3-methoxyphenyl)ethyl-methyl-amino]-2-propan-2-yl-pentanenitrile hydrochloride

Systemtic Name: 2-(3,4-dimethoxyphenyl)-3-[2-(3-methoxyphenyl)ethyl-methyl-amino]-2-propan-2-yl-pentanenitrile hydrochloride Openeye Name: 2-(3,4-dimethoxyphenyl)-2-isopropyl-3-[2-(3-methoxyphenyl)ethyl-methyl-amino]pentanenitrile hydrochloride CAS Name: 2-(3,4-dimethoxyphenyl)-3-[2-(3-methoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile hydrochloride IUPAC Name: 2-(3,4-dimethoxyphenyl)-3-[2-(3-methoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile hydrochloride Traditional Name: 2-(3,4-dimethoxyphenyl)-2-isopropyl-3-[2-(3-methoxyphenyl)ethyl-methyl-amino]valeronitrile hydrochloride Formula: C26H37ClN2O3 MolecularWeight: 461.03658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H36N2O3.ClH/c1-8-25(28(4)15-14-20-10-9-11-22(16-20)29-5)26(18-27,19(2)3)21-12-13-23(30-6)24(17-21)31-7;/h9-13,16-17,19,25H,8,14-15H2,1-7H3;1H