methyl 6-fluoranyl-4-(1-methoxy-1-oxidanylidene-4-phenyl-butan-2-yl)oxy-quinoline-2-carboxylate

Systemtic Name: methyl 6-fluoranyl-4-(1-methoxy-1-oxidanylidene-4-phenyl-butan-2-yl)oxy-quinoline-2-carboxylate Openeye Name: methyl 6-fluoro-4-(1-methoxycarbonyl-3-phenyl-propoxy)quinoline-2-carboxylate CAS Name: 6-fluoro-4-(1-methoxy-1-oxo-4-phenylbutan-2-yl)oxy-2-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 6-fluoro-4-(1-methoxy-1-oxo-4-phenylbutan-2-yl)oxyquinoline-2-carboxylate Traditional Name: 4-(1-carbomethoxy-3-phenyl-propoxy)-6-fluoro-quinaldic acid methyl ester Formula: C22H20FNO5 MolecularWeight: 397.396303

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC2=C(C=C(C=C2)F)C(=C1)OC(CCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)C1=NC2=C(C=C(C=C2)F)C(=C1)OC(CCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C22H20FNO5/c1-27-21(25)18-13-20(16-12-15(23)9-10-17(16)24-18)29-19(22(26)28-2)11-8-14-6-4-3-5-7-14/h3-7,9-10,12-13,19H,8,11H2,1-2H3