2-[3-(4-oxidanyl-1-quinolin-4-ylcarbonyl-piperidin-4-yl)phenyl]ethanoic acid

Systemtic Name: 2-[3-(4-oxidanyl-1-quinolin-4-ylcarbonyl-piperidin-4-yl)phenyl]ethanoic acid Openeye Name: 2-[3-[4-hydroxy-1-(quinoline-4-carbonyl)-4-piperidyl]phenyl]acetic acid CAS Name: 2-[3-[4-hydroxy-1-[oxo(4-quinolinyl)methyl]-4-piperidinyl]phenyl]acetic acid IUPAC Name: 2-[3-[4-hydroxy-1-(quinoline-4-carbonyl)piperidin-4-yl]phenyl]acetic acid Traditional Name: 2-[3-(1-cinchoninoyl-4-hydroxy-4-piperidyl)phenyl]acetic acid Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC(=CC=C2)CC(=O)O)O)C(=O)C3=CC=NC4=CC=CC=C34

Isomeric SMILES

C1CN(CCC1(C2=CC(=CC=C2)CC(=O)O)O)C(=O)C3=CC=NC4=CC=CC=C34

InChI

InChI=1S/C23H22N2O4/c26-21(27)15-16-4-3-5-17(14-16)23(29)9-12-25(13-10-23)22(28)19-8-11-24-20-7-2-1-6-18(19)20/h1-8,11,14,29H,9-10,12-13,15H2,(H,26,27)