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

Systemtic Name: 3-[2-cyclohexylethyl(methyl)amino]-2-(3,4-dimethoxyphenyl)-2-propan-2-yl-pentanenitrile hydrochloride Openeye Name: 3-[2-cyclohexylethyl(methyl)amino]-2-(3,4-dimethoxyphenyl)-2-isopropyl-pentanenitrile hydrochloride CAS Name: 3-[2-cyclohexylethyl(methyl)amino]-2-(3,4-dimethoxyphenyl)-2-propan-2-ylpentanenitrile hydrochloride IUPAC Name: 3-[2-cyclohexylethyl(methyl)amino]-2-(3,4-dimethoxyphenyl)-2-propan-2-ylpentanenitrile hydrochloride Traditional Name: 3-[2-cyclohexylethyl(methyl)amino]-2-(3,4-dimethoxyphenyl)-2-isopropyl-valeronitrile hydrochloride Formula: C25H41ClN2O2 MolecularWeight: 437.05824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C#N)(C1=CC(=C(C=C1)OC)OC)C(C)C)N(C)CCC2CCCCC2.Cl

Isomeric SMILES

CCC(C(C#N)(C1=CC(=C(C=C1)OC)OC)C(C)C)N(C)CCC2CCCCC2.Cl

InChI

InChI=1S/C25H40N2O2.ClH/c1-7-24(27(4)16-15-20-11-9-8-10-12-20)25(18-26,19(2)3)21-13-14-22(28-5)23(17-21)29-6;/h13-14,17,19-20,24H,7-12,15-16H2,1-6H3;1H