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

Systemtic Name: 1-[(3,4-dimethoxyphenyl)-quinolin-4-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(3,4-dimethoxyphenyl)-(4-quinolyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(3,4-dimethoxyphenyl)-(4-quinolinyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(3,4-dimethoxyphenyl)-quinolin-4-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(3,4-dimethoxyphenyl)-(4-quinolyl)methyl]isonipecotic acid Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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