2-ethyl-3,4-diphenyl-2-pyrrolidin-3-yl-1-(3,4,5-trimethoxyphenyl)carbonyl-piperidine-4-carboxylic acid

Systemtic Name: 2-ethyl-3,4-diphenyl-2-pyrrolidin-3-yl-1-(3,4,5-trimethoxyphenyl)carbonyl-piperidine-4-carboxylic acid Openeye Name: 2-ethyl-3,4-diphenyl-2-pyrrolidin-3-yl-1-(3,4,5-trimethoxybenzoyl)piperidine-4-carboxylic acid CAS Name: 2-ethyl-1-[oxo-(3,4,5-trimethoxyphenyl)methyl]-3,4-diphenyl-2-(3-pyrrolidinyl)-4-piperidinecarboxylic acid IUPAC Name: 2-ethyl-3,4-diphenyl-2-pyrrolidin-3-yl-1-(3,4,5-trimethoxybenzoyl)piperidine-4-carboxylic acid Traditional Name: 2-ethyl-3,4-diphenyl-2-pyrrolidin-3-yl-1-(3,4,5-trimethoxybenzoyl)isonipecotic acid Formula: C34H40N2O6 MolecularWeight: 572.6912

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(C(CCN1C(=O)C2=CC(=C(C(=C2)OC)OC)OC)(C3=CC=CC=C3)C(=O)O)C4=CC=CC=C4)C5CCNC5

Isomeric SMILES

CCC1(C(C(CCN1C(=O)C2=CC(=C(C(=C2)OC)OC)OC)(C3=CC=CC=C3)C(=O)O)C4=CC=CC=C4)C5CCNC5

InChI

InChI=1S/C34H40N2O6/c1-5-34(26-16-18-35-22-26)30(23-12-8-6-9-13-23)33(32(38)39,25-14-10-7-11-15-25)17-19-36(34)31(37)24-20-27(40-2)29(42-4)28(21-24)41-3/h6-15,20-21,26,30,35H,5,16-19,22H2,1-4H3,(H,38,39)