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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(C2=C(C(=CC=C2)Cl)Cl)C3=CC=NC4=CC=CC=C34)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(C2=C(C(=CC=C2)Cl)Cl)C3=CC=NC4=CC=CC=C34)C(=O)O

InChI

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