methyl 1-[3-(3-fluoranyl-6-methoxy-quinolin-4-yl)propyl]azetidine-3-carboxylate dihydrochloride

Systemtic Name: methyl 1-[3-(3-fluoranyl-6-methoxy-quinolin-4-yl)propyl]azetidine-3-carboxylate dihydrochloride Openeye Name: methyl 1-[3-(3-fluoro-6-methoxy-4-quinolyl)propyl]azetidine-3-carboxylate dihydrochloride CAS Name: 1-[3-(3-fluoro-6-methoxy-4-quinolinyl)propyl]-3-azetidinecarboxylic acid methyl ester dihydrochloride IUPAC Name: methyl 1-[3-(3-fluoro-6-methoxyquinolin-4-yl)propyl]azetidine-3-carboxylate dihydrochloride Traditional Name: 1-[3-(3-fluoro-6-methoxy-4-quinolyl)propyl]azetidine-3-carboxylic acid methyl ester dihydrochloride Formula: C18H23Cl2FN2O3 MolecularWeight: 405.291223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C(=CN=C2C=C1)F)CCCN3CC(C3)C(=O)OC.Cl.Cl

Isomeric SMILES

COC1=CC2=C(C(=CN=C2C=C1)F)CCCN3CC(C3)C(=O)OC.Cl.Cl

InChI

InChI=1S/C18H21FN2O3.2ClH/c1-23-13-5-6-17-15(8-13)14(16(19)9-20-17)4-3-7-21-10-12(11-21)18(22)24-2;;/h5-6,8-9,12H,3-4,7,10-11H2,1-2H3;2*1H