2-[[4-(6-bromanyl-2-methyl-quinolin-4-yl)oxypiperidin-1-yl]methyl]-3-fluoranyl-benzoic acid

Systemtic Name: 2-[[4-(6-bromanyl-2-methyl-quinolin-4-yl)oxypiperidin-1-yl]methyl]-3-fluoranyl-benzoic acid Openeye Name: 2-[[4-[(6-bromo-2-methyl-4-quinolyl)oxy]-1-piperidyl]methyl]-3-fluoro-benzoic acid CAS Name: 2-[[4-[(6-bromo-2-methyl-4-quinolinyl)oxy]-1-piperidinyl]methyl]-3-fluorobenzoic acid IUPAC Name: 2-[[4-(6-bromo-2-methylquinolin-4-yl)oxypiperidin-1-yl]methyl]-3-fluorobenzoic acid Traditional Name: 2-[[4-[(6-bromo-2-methyl-4-quinolyl)oxy]piperidino]methyl]-3-fluoro-benzoic acid Formula: C23H22BrFN2O3 MolecularWeight: 473.334783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)Br)C(=C1)OC3CCN(CC3)CC4=C(C=CC=C4F)C(=O)O

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)Br)C(=C1)OC3CCN(CC3)CC4=C(C=CC=C4F)C(=O)O

InChI

InChI=1S/C23H22BrFN2O3/c1-14-11-22(18-12-15(24)5-6-21(18)26-14)30-16-7-9-27(10-8-16)13-19-17(23(28)29)3-2-4-20(19)25/h2-6,11-12,16H,7-10,13H2,1H3,(H,28,29)