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

Systemtic Name: 5-[2-(2-butyl-4,5-dimethoxy-phenyl)ethyl-methyl-amino]-4-oxidanyl-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile Openeye Name: 5-[2-(2-butyl-4,5-dimethoxy-phenyl)ethyl-methyl-amino]-4-hydroxy-2-isopropyl-2-(3,4,5-trimethoxyphenyl)pentanenitrile CAS Name: 5-[2-(2-butyl-4,5-dimethoxyphenyl)ethyl-methylamino]-4-hydroxy-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile IUPAC Name: 5-[2-(2-butyl-4,5-dimethoxyphenyl)ethyl-methylamino]-4-hydroxy-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile Traditional Name: 5-[2-(2-butyl-4,5-dimethoxy-phenyl)ethyl-methyl-amino]-4-hydroxy-2-isopropyl-2-(3,4,5-trimethoxyphenyl)valeronitrile Formula: C32H48N2O6 MolecularWeight: 556.73332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H48N2O6/c1-10-11-12-23-15-27(36-5)28(37-6)16-24(23)13-14-34(4)20-26(35)19-32(21-33,22(2)3)25-17-29(38-7)31(40-9)30(18-25)39-8/h15-18,22,26,35H,10-14,19-20H2,1-9H3