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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(C2=CC3=CC=CC=C3N=C2)N4CCCCC4C(=O)O)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(C2=CC3=CC=CC=C3N=C2)N4CCCCC4C(=O)O)OC)OC

InChI

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