1-[(2,6-dimethoxyphenyl)-quinolin-4-yl-methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(2,6-dimethoxyphenyl)-quinolin-4-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(2,6-dimethoxyphenyl)-(4-quinolyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(2,6-dimethoxyphenyl)-(4-quinolinyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(2,6-dimethoxyphenyl)-quinolin-4-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(2,6-dimethoxyphenyl)-(4-quinolyl)methyl]isonipecotic acid Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(C2=CC=NC3=CC=CC=C23)N4CCC(CC4)C(=O)O

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(C2=CC=NC3=CC=CC=C23)N4CCC(CC4)C(=O)O

InChI

InChI=1S/C24H26N2O4/c1-29-20-8-5-9-21(30-2)22(20)23(26-14-11-16(12-15-26)24(27)28)18-10-13-25-19-7-4-3-6-17(18)19/h3-10,13,16,23H,11-12,14-15H2,1-2H3,(H,27,28)