1-[(5-chloranyl-2-methoxy-phenyl)-quinolin-4-yl-methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(5-chloranyl-2-methoxy-phenyl)-quinolin-4-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(5-chloro-2-methoxy-phenyl)-(4-quinolyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(5-chloro-2-methoxyphenyl)-(4-quinolinyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(5-chloro-2-methoxyphenyl)-quinolin-4-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(5-chloro-2-methoxy-phenyl)-(4-quinolyl)methyl]pipecolinic acid Formula: C23H23ClN2O3 MolecularWeight: 410.89332

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(C2=CC=NC3=CC=CC=C23)N4CCCCC4C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(C2=CC=NC3=CC=CC=C23)N4CCCCC4C(=O)O

InChI

InChI=1S/C23H23ClN2O3/c1-29-21-10-9-15(24)14-18(21)22(26-13-5-4-8-20(26)23(27)28)17-11-12-25-19-7-3-2-6-16(17)19/h2-3,6-7,9-12,14,20,22H,4-5,8,13H2,1H3,(H,27,28)