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

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-2-isopropyl-2-(3,4,5-trimethoxyphenyl)pentanenitrile CAS Name: 3-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile Traditional Name: 3-[homoveratryl(methyl)amino]-2-isopropyl-2-(3,4,5-trimethoxyphenyl)valeronitrile Formula: C28H40N2O5 MolecularWeight: 484.6276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H40N2O5/c1-10-26(30(4)14-13-20-11-12-22(31-5)23(15-20)32-6)28(18-29,19(2)3)21-16-24(33-7)27(35-9)25(17-21)34-8/h11-12,15-17,19,26H,10,13-14H2,1-9H3