5-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-2-(2-methylphenyl)-2-propyl-pentanenitrile

Systemtic Name: 5-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-2-(2-methylphenyl)-2-propyl-pentanenitrile Openeye Name: 5-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-2-(o-tolyl)-2-propyl-pentanenitrile CAS Name: 5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-(2-methylphenyl)-2-propylpentanenitrile IUPAC Name: 5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-(2-methylphenyl)-2-propylpentanenitrile Traditional Name: 5-[homoveratryl(methyl)amino]-2-(o-tolyl)-2-propyl-valeronitrile Formula: C26H36N2O2 MolecularWeight: 408.57624

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCCN(C)CCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC=CC=C2C

Isomeric SMILES

CCCC(CCCN(C)CCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC=CC=C2C

InChI

InChI=1S/C26H36N2O2/c1-6-15-26(20-27,23-11-8-7-10-21(23)2)16-9-17-28(3)18-14-22-12-13-24(29-4)25(19-22)30-5/h7-8,10-13,19H,6,9,14-18H2,1-5H3