ethyl 6-cyano-6-(3,4-dimethoxyphenyl)-2-[(3,4-dimethoxyphenyl)methyl-methyl-amino]-7-methyl-octanoate

Systemtic Name: ethyl 6-cyano-6-(3,4-dimethoxyphenyl)-2-[(3,4-dimethoxyphenyl)methyl-methyl-amino]-7-methyl-octanoate Openeye Name: ethyl 6-cyano-6-(3,4-dimethoxyphenyl)-2-[(3,4-dimethoxyphenyl)methyl-methyl-amino]-7-methyl-octanoate CAS Name: 6-cyano-6-(3,4-dimethoxyphenyl)-2-[(3,4-dimethoxyphenyl)methyl-methylamino]-7-methyloctanoic acid ethyl ester IUPAC Name: ethyl 6-cyano-6-(3,4-dimethoxyphenyl)-2-[(3,4-dimethoxyphenyl)methyl-methylamino]-7-methyloctanoate Traditional Name: 6-cyano-6-(3,4-dimethoxyphenyl)-7-methyl-2-[methyl(veratryl)amino]caprylic acid ethyl ester Formula: C30H42N2O6 MolecularWeight: 526.66428

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCC(C#N)(C1=CC(=C(C=C1)OC)OC)C(C)C)N(C)CC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCOC(=O)C(CCCC(C#N)(C1=CC(=C(C=C1)OC)OC)C(C)C)N(C)CC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C30H42N2O6/c1-9-38-29(33)24(32(4)19-22-12-14-25(34-5)27(17-22)36-7)11-10-16-30(20-31,21(2)3)23-13-15-26(35-6)28(18-23)37-8/h12-15,17-18,21,24H,9-11,16,19H2,1-8H3