1-[(2,4-dichlorophenyl)-(4-phenylphenyl)methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(2,4-dichlorophenyl)-(4-phenylphenyl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(2,4-dichlorophenyl)-(4-phenylphenyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(2,4-dichlorophenyl)-(4-phenylphenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(2,4-dichlorophenyl)-(4-phenylphenyl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-[(2,4-dichlorophenyl)-(4-phenylphenyl)methyl]nipecotic acid Formula: C25H23Cl2NO2 MolecularWeight: 440.36162

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(C2=CC=C(C=C2)C3=CC=CC=C3)C4=C(C=C(C=C4)Cl)Cl)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(C2=CC=C(C=C2)C3=CC=CC=C3)C4=C(C=C(C=C4)Cl)Cl)C(=O)O

InChI

InChI=1S/C25H23Cl2NO2/c26-21-12-13-22(23(27)15-21)24(28-14-4-7-20(16-28)25(29)30)19-10-8-18(9-11-19)17-5-2-1-3-6-17/h1-3,5-6,8-13,15,20,24H,4,7,14,16H2,(H,29,30)