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

Systemtic Name: 3-[2-(3-chlorophenyl)ethyl-methyl-amino]-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile Openeye Name: 3-[2-(3-chlorophenyl)ethyl-methyl-amino]-2-isopropyl-2-(3,4,5-trimethoxyphenyl)pentanenitrile CAS Name: 3-[2-(3-chlorophenyl)ethyl-methylamino]-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile IUPAC Name: 3-[2-(3-chlorophenyl)ethyl-methylamino]-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile Traditional Name: 3-[2-(3-chlorophenyl)ethyl-methyl-amino]-2-isopropyl-2-(3,4,5-trimethoxyphenyl)valeronitrile Formula: C26H35ClN2O3 MolecularWeight: 459.0207

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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(=CC=C2)Cl

Isomeric SMILES

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

InChI

InChI=1S/C26H35ClN2O3/c1-8-24(29(4)13-12-19-10-9-11-21(27)14-19)26(17-28,18(2)3)20-15-22(30-5)25(32-7)23(16-20)31-6/h9-11,14-16,18,24H,8,12-13H2,1-7H3