1-[(3-methoxyphenyl)-quinolin-2-yl-methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(3-methoxyphenyl)-quinolin-2-yl-methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(3-methoxyphenyl)-(2-quinolyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(3-methoxyphenyl)-(2-quinolinyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(3-methoxyphenyl)-quinolin-2-ylmethyl]piperidine-3-carboxylic acid Traditional Name: 1-[(3-methoxyphenyl)-(2-quinolyl)methyl]nipecotic acid Formula: C23H24N2O3 MolecularWeight: 376.44826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(C2=NC3=CC=CC=C3C=C2)N4CCCC(C4)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C(C2=NC3=CC=CC=C3C=C2)N4CCCC(C4)C(=O)O

InChI

InChI=1S/C23H24N2O3/c1-28-19-9-4-7-17(14-19)22(25-13-5-8-18(15-25)23(26)27)21-12-11-16-6-2-3-10-20(16)24-21/h2-4,6-7,9-12,14,18,22H,5,8,13,15H2,1H3,(H,26,27)