6-(2-acetamido-5-methyl-pyridin-3-yl)-8-[bis(fluoranyl)methoxy]-1-cyclopropyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-(2-acetamido-5-methyl-pyridin-3-yl)-8-[bis(fluoranyl)methoxy]-1-cyclopropyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-(2-acetamido-5-methyl-3-pyridyl)-1-cyclopropyl-8-(difluoromethoxy)-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-(2-acetamido-5-methyl-3-pyridinyl)-1-cyclopropyl-8-(difluoromethoxy)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-(2-acetamido-5-methylpyridin-3-yl)-1-cyclopropyl-8-(difluoromethoxy)-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-(2-acetamido-5-methyl-3-pyridyl)-1-cyclopropyl-8-(difluoromethoxy)-4-keto-quinoline-3-carboxylic acid Formula: C22H19F2N3O5 MolecularWeight: 443.400166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=C1)C2=CC(=C3C(=C2)C(=O)C(=CN3C4CC4)C(=O)O)OC(F)F)NC(=O)C

Isomeric SMILES

CC1=CN=C(C(=C1)C2=CC(=C3C(=C2)C(=O)C(=CN3C4CC4)C(=O)O)OC(F)F)NC(=O)C

InChI

InChI=1S/C22H19F2N3O5/c1-10-5-14(20(25-8-10)26-11(2)28)12-6-15-18(17(7-12)32-22(23)24)27(13-3-4-13)9-16(19(15)29)21(30)31/h5-9,13,22H,3-4H2,1-2H3,(H,30,31)(H,25,26,28)