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

Systemtic Name: propan-2-yl 2-cyano-2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]pentanoate Openeye Name: isopropyl 2-cyano-2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]pentanoate CAS Name: 2-cyano-2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]pentanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-cyano-2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]pentanoate Traditional Name: 2-cyano-2-(3,4-dimethoxyphenyl)-5-[homoveratryl(methyl)amino]valeric acid isopropyl ester Formula: C28H38N2O6 MolecularWeight: 498.61112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H38N2O6/c1-20(2)36-27(31)28(19-29,22-10-12-24(33-5)26(18-22)35-7)14-8-15-30(3)16-13-21-9-11-23(32-4)25(17-21)34-6/h9-12,17-18,20H,8,13-16H2,1-7H3