1-[quinolin-3-yl-(2,4,5-trimethoxyphenyl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[quinolin-3-yl-(2,4,5-trimethoxyphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[3-quinolyl-(2,4,5-trimethoxyphenyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[3-quinolinyl-(2,4,5-trimethoxyphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[quinolin-3-yl-(2,4,5-trimethoxyphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[asaryl(3-quinolyl)methyl]pipecolinic acid Formula: C25H28N2O5 MolecularWeight: 436.50022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(C2=CC3=CC=CC=C3N=C2)N4CCCCC4C(=O)O)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(C2=CC3=CC=CC=C3N=C2)N4CCCCC4C(=O)O)OC)OC

InChI

InChI=1S/C25H28N2O5/c1-30-21-14-23(32-3)22(31-2)13-18(21)24(27-11-7-6-10-20(27)25(28)29)17-12-16-8-4-5-9-19(16)26-15-17/h4-5,8-9,12-15,20,24H,6-7,10-11H2,1-3H3,(H,28,29)