5-acetamido-6,7-bis(fluoranyl)-1-(2-fluoranylcyclopropyl)-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-acetamido-6,7-bis(fluoranyl)-1-(2-fluoranylcyclopropyl)-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-acetamido-6,7-difluoro-1-(2-fluorocyclopropyl)-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-acetamido-6,7-difluoro-1-(2-fluorocyclopropyl)-8-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-acetamido-6,7-difluoro-1-(2-fluorocyclopropyl)-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-acetamido-6,7-difluoro-1-(2-fluorocyclopropyl)-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C16H13F3N2O4 MolecularWeight: 354.28063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)O)C3CC3F)NC(=O)C)F)F

Isomeric SMILES

CC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)O)C3CC3F)NC(=O)C)F)F

InChI

InChI=1S/C16H13F3N2O4/c1-5-11(18)12(19)13(20-6(2)22)10-14(5)21(9-3-8(9)17)4-7(15(10)23)16(24)25/h4,8-9H,3H2,1-2H3,(H,20,22)(H,24,25)