[1-[4-[bis(fluoranyl)methoxy]phenyl]-1-oxidanylidene-propan-2-yl] 6-methoxyquinoline-2-carboxylate

Systemtic Name: [1-[4-[bis(fluoranyl)methoxy]phenyl]-1-oxidanylidene-propan-2-yl] 6-methoxyquinoline-2-carboxylate Openeye Name: [2-[4-(difluoromethoxy)phenyl]-1-methyl-2-oxo-ethyl] 6-methoxyquinoline-2-carboxylate CAS Name: 6-methoxy-2-quinolinecarboxylic acid [1-[4-(difluoromethoxy)phenyl]-1-oxopropan-2-yl] ester IUPAC Name: [1-[4-(difluoromethoxy)phenyl]-1-oxopropan-2-yl] 6-methoxyquinoline-2-carboxylate Traditional Name: 6-methoxyquinaldic acid [2-[4-(difluoromethoxy)phenyl]-2-keto-1-methyl-ethyl] ester Formula: C21H17F2NO5 MolecularWeight: 401.360186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)OC(F)F)OC(=O)C2=NC3=C(C=C2)C=C(C=C3)OC

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)OC(F)F)OC(=O)C2=NC3=C(C=C2)C=C(C=C3)OC

InChI

InChI=1S/C21H17F2NO5/c1-12(19(25)13-3-6-15(7-4-13)29-21(22)23)28-20(26)18-9-5-14-11-16(27-2)8-10-17(14)24-18/h3-12,21H,1-2H3