3-(3,4-dichlorophenyl)-5-oxidanylidene-4-phenyl-2-propyl-2-pyrrolidin-3-yl-1-(3,4,5-trimethoxyphenyl)carbonyl-piperidine-4-carboxylic acid

Systemtic Name: 3-(3,4-dichlorophenyl)-5-oxidanylidene-4-phenyl-2-propyl-2-pyrrolidin-3-yl-1-(3,4,5-trimethoxyphenyl)carbonyl-piperidine-4-carboxylic acid Openeye Name: 3-(3,4-dichlorophenyl)-5-oxo-4-phenyl-2-propyl-2-pyrrolidin-3-yl-1-(3,4,5-trimethoxybenzoyl)piperidine-4-carboxylic acid CAS Name: 3-(3,4-dichlorophenyl)-5-oxo-1-[oxo-(3,4,5-trimethoxyphenyl)methyl]-4-phenyl-2-propyl-2-(3-pyrrolidinyl)-4-piperidinecarboxylic acid IUPAC Name: 3-(3,4-dichlorophenyl)-5-oxo-4-phenyl-2-propyl-2-pyrrolidin-3-yl-1-(3,4,5-trimethoxybenzoyl)piperidine-4-carboxylic acid Traditional Name: 3-(3,4-dichlorophenyl)-5-keto-4-phenyl-2-propyl-2-pyrrolidin-3-yl-1-(3,4,5-trimethoxybenzoyl)isonipecotic acid Formula: C35H38Cl2N2O7 MolecularWeight: 669.59142

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(C(C(=O)CN1C(=O)C2=CC(=C(C(=C2)OC)OC)OC)(C3=CC=CC=C3)C(=O)O)C4=CC(=C(C=C4)Cl)Cl)C5CCNC5

Isomeric SMILES

CCCC1(C(C(C(=O)CN1C(=O)C2=CC(=C(C(=C2)OC)OC)OC)(C3=CC=CC=C3)C(=O)O)C4=CC(=C(C=C4)Cl)Cl)C5CCNC5

InChI

InChI=1S/C35H38Cl2N2O7/c1-5-14-34(24-13-15-38-19-24)31(21-11-12-25(36)26(37)16-21)35(33(42)43,23-9-7-6-8-10-23)29(40)20-39(34)32(41)22-17-27(44-2)30(46-4)28(18-22)45-3/h6-12,16-18,24,31,38H,5,13-15,19-20H2,1-4H3,(H,42,43)