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

Systemtic Name: 2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-4-oxidanyl-2-propan-2-yl-pentanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-4-hydroxy-2-isopropyl-pentanenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-4-hydroxy-2-propan-2-ylpentanenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-4-hydroxy-2-propan-2-ylpentanenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-5-[homoveratryl(methyl)amino]-4-hydroxy-2-isopropyl-valeronitrile Formula: C27H38N2O5 MolecularWeight: 470.60102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(CN(C)CCC1=CC(=C(C=C1)OC)OC)O)(C#N)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)C(CC(CN(C)CCC1=CC(=C(C=C1)OC)OC)O)(C#N)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C27H38N2O5/c1-19(2)27(18-28,21-9-11-24(32-5)26(15-21)34-7)16-22(30)17-29(3)13-12-20-8-10-23(31-4)25(14-20)33-6/h8-11,14-15,19,22,30H,12-13,16-17H2,1-7H3