1-[2-[3-(3,4-dichlorophenyl)pyrrolidin-3-yl]ethyl]-4-phenyl-piperidine-4-carboxylic acid

Systemtic Name: 1-[2-[3-(3,4-dichlorophenyl)pyrrolidin-3-yl]ethyl]-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-[2-[3-(3,4-dichlorophenyl)pyrrolidin-3-yl]ethyl]-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-[2-[3-(3,4-dichlorophenyl)-3-pyrrolidinyl]ethyl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-[2-[3-(3,4-dichlorophenyl)pyrrolidin-3-yl]ethyl]-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-[2-[3-(3,4-dichlorophenyl)pyrrolidin-3-yl]ethyl]-4-phenyl-isonipecotic acid Formula: C24H28Cl2N2O2 MolecularWeight: 447.39732

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1(CCN2CCC(CC2)(C3=CC=CC=C3)C(=O)O)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1CNCC1(CCN2CCC(CC2)(C3=CC=CC=C3)C(=O)O)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C24H28Cl2N2O2/c25-20-7-6-19(16-21(20)26)23(8-12-27-17-23)9-13-28-14-10-24(11-15-28,22(29)30)18-4-2-1-3-5-18/h1-7,16,27H,8-15,17H2,(H,29,30)