2-[4-[3-(3-fluoranyl-6-methoxy-quinolin-4-yl)-3-oxidanyl-propyl]-1-methyl-piperidin-3-yl]ethanoate hydrochloride

Systemtic Name: 2-[4-[3-(3-fluoranyl-6-methoxy-quinolin-4-yl)-3-oxidanyl-propyl]-1-methyl-piperidin-3-yl]ethanoate hydrochloride Openeye Name: 2-[4-[3-(3-fluoro-6-methoxy-4-quinolyl)-3-hydroxy-propyl]-1-methyl-3-piperidyl]acetate hydrochloride CAS Name: 2-[4-[3-(3-fluoro-6-methoxy-4-quinolinyl)-3-hydroxypropyl]-1-methyl-3-piperidinyl]acetate hydrochloride IUPAC Name: 2-[4-[3-(3-fluoro-6-methoxyquinolin-4-yl)-3-hydroxypropyl]-1-methylpiperidin-3-yl]acetate hydrochloride Traditional Name: 2-[4-[3-(3-fluoro-6-methoxy-4-quinolyl)-3-hydroxy-propyl]-1-methyl-3-piperidyl]acetate hydrochloride Formula: C21H27ClFN2O4- MolecularWeight: 425.901483

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C(C1)CC(=O)[O-])CCC(C2=C3C=C(C=CC3=NC=C2F)OC)O.Cl

Isomeric SMILES

CN1CCC(C(C1)CC(=O)[O-])CCC(C2=C3C=C(C=CC3=NC=C2F)OC)O.Cl

InChI

InChI=1S/C21H27FN2O4.ClH/c1-24-8-7-13(14(12-24)9-20(26)27)3-6-19(25)21-16-10-15(28-2)4-5-18(16)23-11-17(21)22;/h4-5,10-11,13-14,19,25H,3,6-9,12H2,1-2H3,(H,26,27);1H/p-1