5-[2-(2-butyl-4,5-dimethoxy-phenyl)ethyl-methyl-amino]-2-(3,4-dimethoxyphenyl)-2-propan-2-yl-pentanenitrile

Systemtic Name: 5-[2-(2-butyl-4,5-dimethoxy-phenyl)ethyl-methyl-amino]-2-(3,4-dimethoxyphenyl)-2-propan-2-yl-pentanenitrile Openeye Name: 5-[2-(2-butyl-4,5-dimethoxy-phenyl)ethyl-methyl-amino]-2-(3,4-dimethoxyphenyl)-2-isopropyl-pentanenitrile CAS Name: 5-[2-(2-butyl-4,5-dimethoxyphenyl)ethyl-methylamino]-2-(3,4-dimethoxyphenyl)-2-propan-2-ylpentanenitrile IUPAC Name: 5-[2-(2-butyl-4,5-dimethoxyphenyl)ethyl-methylamino]-2-(3,4-dimethoxyphenyl)-2-propan-2-ylpentanenitrile Traditional Name: 5-[2-(2-butyl-4,5-dimethoxy-phenyl)ethyl-methyl-amino]-2-(3,4-dimethoxyphenyl)-2-isopropyl-valeronitrile Formula: C31H46N2O4 MolecularWeight: 510.70794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1CCN(C)CCCC(C#N)(C2=CC(=C(C=C2)OC)OC)C(C)C)OC)OC

Isomeric SMILES

CCCCC1=CC(=C(C=C1CCN(C)CCCC(C#N)(C2=CC(=C(C=C2)OC)OC)C(C)C)OC)OC

InChI

InChI=1S/C31H46N2O4/c1-9-10-12-24-19-28(35-6)29(36-7)20-25(24)15-18-33(4)17-11-16-31(22-32,23(2)3)26-13-14-27(34-5)30(21-26)37-8/h13-14,19-21,23H,9-12,15-18H2,1-8H3