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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=CC(=C(C=C2)Cl)Cl)C3=CC=NC4=CC=CC=C34

Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=CC(=C(C=C2)Cl)Cl)C3=CC=NC4=CC=CC=C34

InChI

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