7-azanyl-1-[5-azanyl-2,4-bis(fluoranyl)phenyl]-8-methyl-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-azanyl-1-[5-azanyl-2,4-bis(fluoranyl)phenyl]-8-methyl-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-amino-1-(5-amino-2,4-difluoro-phenyl)-8-methyl-6-nitro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-amino-1-(5-amino-2,4-difluorophenyl)-8-methyl-6-nitro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-amino-1-(5-amino-2,4-difluorophenyl)-8-methyl-6-nitro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-amino-1-(5-amino-2,4-difluoro-phenyl)-4-keto-8-methyl-6-nitro-quinoline-3-carboxylic acid Formula: C17H12F2N4O5 MolecularWeight: 390.297786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1N)[N+](=O)[O-])C(=O)C(=CN2C3=CC(=C(C=C3F)F)N)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=C1N)[N+](=O)[O-])C(=O)C(=CN2C3=CC(=C(C=C3F)F)N)C(=O)O

InChI

InChI=1S/C17H12F2N4O5/c1-6-14(21)13(23(27)28)2-7-15(6)22(5-8(16(7)24)17(25)26)12-4-11(20)9(18)3-10(12)19/h2-5H,20-21H2,1H3,(H,25,26)