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

Systemtic Name: 1-[(2,4-dichlorophenyl)-quinolin-3-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(2,4-dichlorophenyl)-(3-quinolyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(2,4-dichlorophenyl)-(3-quinolinyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(2,4-dichlorophenyl)-quinolin-3-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(2,4-dichlorophenyl)-(3-quinolyl)methyl]pipecolinic acid Formula: C22H20Cl2N2O2 MolecularWeight: 415.3124

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(C2=C(C=C(C=C2)Cl)Cl)C3=CC4=CC=CC=C4N=C3

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(C2=C(C=C(C=C2)Cl)Cl)C3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C22H20Cl2N2O2/c23-16-8-9-17(18(24)12-16)21(26-10-4-3-7-20(26)22(27)28)15-11-14-5-1-2-6-19(14)25-13-15/h1-2,5-6,8-9,11-13,20-21H,3-4,7,10H2,(H,27,28)