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

Systemtic Name: 6-azanyl-8-[bis(fluoranyl)methoxy]-1-cyclopropyl-5-methyl-4-oxidanylidene-2-pyridin-3-yl-quinoline-3-carboxylic acid Openeye Name: 6-amino-1-cyclopropyl-8-(difluoromethoxy)-5-methyl-4-oxo-2-(3-pyridyl)quinoline-3-carboxylic acid CAS Name: 6-amino-1-cyclopropyl-8-(difluoromethoxy)-5-methyl-4-oxo-2-(3-pyridinyl)-3-quinolinecarboxylic acid IUPAC Name: 6-amino-1-cyclopropyl-8-(difluoromethoxy)-5-methyl-4-oxo-2-pyridin-3-ylquinoline-3-carboxylic acid Traditional Name: 6-amino-1-cyclopropyl-8-(difluoromethoxy)-4-keto-5-methyl-2-(3-pyridyl)quinoline-3-carboxylic acid Formula: C20H17F2N3O4 MolecularWeight: 401.363486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1N)OC(F)F)N(C(=C(C2=O)C(=O)O)C3=CN=CC=C3)C4CC4

Isomeric SMILES

CC1=C2C(=C(C=C1N)OC(F)F)N(C(=C(C2=O)C(=O)O)C3=CN=CC=C3)C4CC4

InChI

InChI=1S/C20H17F2N3O4/c1-9-12(23)7-13(29-20(21)22)17-14(9)18(26)15(19(27)28)16(25(17)11-4-5-11)10-3-2-6-24-8-10/h2-3,6-8,11,20H,4-5,23H2,1H3,(H,27,28)