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

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-2-(3-ethoxyphenyl)-2-propan-2-yl-pentanenitrile Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-2-(3-ethoxyphenyl)-2-isopropyl-pentanenitrile CAS Name: 3-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-(3-ethoxyphenyl)-2-propan-2-ylpentanenitrile IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-(3-ethoxyphenyl)-2-propan-2-ylpentanenitrile Traditional Name: 3-[homoveratryl(methyl)amino]-2-isopropyl-2-m-phenetyl-valeronitrile Formula: C27H38N2O3 MolecularWeight: 438.60222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H38N2O3/c1-8-26(29(5)16-15-21-13-14-24(30-6)25(17-21)31-7)27(19-28,20(3)4)22-11-10-12-23(18-22)32-9-2/h10-14,17-18,20,26H,8-9,15-16H2,1-7H3