1-cyclopropyl-6,7-bis(fluoranyl)-5-methoxy-4-oxidanylidene-8-(trifluoromethyl)quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6,7-bis(fluoranyl)-5-methoxy-4-oxidanylidene-8-(trifluoromethyl)quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6,7-difluoro-5-methoxy-4-oxo-8-(trifluoromethyl)quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6,7-difluoro-5-methoxy-4-oxo-8-(trifluoromethyl)-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6,7-difluoro-5-methoxy-4-oxo-8-(trifluoromethyl)quinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6,7-difluoro-4-keto-5-methoxy-8-(trifluoromethyl)quinoline-3-carboxylic acid Formula: C15H10F5NO4 MolecularWeight: 363.236216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C2=C1C(=O)C(=CN2C3CC3)C(=O)O)C(F)(F)F)F)F

Isomeric SMILES

COC1=C(C(=C(C2=C1C(=O)C(=CN2C3CC3)C(=O)O)C(F)(F)F)F)F

InChI

InChI=1S/C15H10F5NO4/c1-25-13-7-11(8(15(18,19)20)9(16)10(13)17)21(5-2-3-5)4-6(12(7)22)14(23)24/h4-5H,2-3H2,1H3,(H,23,24)