3-(3,4-dichlorophenyl)-1-[3-methoxy-1-(2-methoxyphenyl)-1-oxidanylidene-2-pyrrolidin-3-yl-propan-2-yl]-4-phenyl-piperidine-4-carboxylic acid

Systemtic Name: 3-(3,4-dichlorophenyl)-1-[3-methoxy-1-(2-methoxyphenyl)-1-oxidanylidene-2-pyrrolidin-3-yl-propan-2-yl]-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 3-(3,4-dichlorophenyl)-1-[1-(methoxymethyl)-2-(2-methoxyphenyl)-2-oxo-1-pyrrolidin-3-yl-ethyl]-4-phenyl-piperidine-4-carboxylic acid CAS Name: 3-(3,4-dichlorophenyl)-1-[3-methoxy-1-(2-methoxyphenyl)-1-oxo-2-(3-pyrrolidinyl)propan-2-yl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 3-(3,4-dichlorophenyl)-1-[3-methoxy-1-(2-methoxyphenyl)-1-oxo-2-pyrrolidin-3-ylpropan-2-yl]-4-phenylpiperidine-4-carboxylic acid Traditional Name: 3-(3,4-dichlorophenyl)-1-[2-keto-1-(methoxymethyl)-2-(2-methoxyphenyl)-1-pyrrolidin-3-yl-ethyl]-4-phenyl-isonipecotic acid Formula: C33H36Cl2N2O5 MolecularWeight: 611.55534

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Descriptors Computed from Structure

Canonical SMILES:

COCC(C1CCNC1)(C(=O)C2=CC=CC=C2OC)N3CCC(C(C3)C4=CC(=C(C=C4)Cl)Cl)(C5=CC=CC=C5)C(=O)O

Isomeric SMILES

COCC(C1CCNC1)(C(=O)C2=CC=CC=C2OC)N3CCC(C(C3)C4=CC(=C(C=C4)Cl)Cl)(C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C33H36Cl2N2O5/c1-41-21-33(24-14-16-36-19-24,30(38)25-10-6-7-11-29(25)42-2)37-17-15-32(31(39)40,23-8-4-3-5-9-23)26(20-37)22-12-13-27(34)28(35)18-22/h3-13,18,24,26,36H,14-17,19-21H2,1-2H3,(H,39,40)