6-[2-[[(4-carboxy-2-fluoranyl-phenyl)carbamoylamino]methyl]imidazol-1-yl]-7-nitro-2-oxidanylidene-1H-quinoline-3-carboxylic acid

Systemtic Name: 6-[2-[[(4-carboxy-2-fluoranyl-phenyl)carbamoylamino]methyl]imidazol-1-yl]-7-nitro-2-oxidanylidene-1H-quinoline-3-carboxylic acid Openeye Name: 6-[2-[[(4-carboxy-2-fluoro-phenyl)carbamoylamino]methyl]imidazol-1-yl]-7-nitro-2-oxo-1H-quinoline-3-carboxylic acid CAS Name: 6-[2-[[[(4-carboxy-2-fluoroanilino)-oxomethyl]amino]methyl]-1-imidazolyl]-7-nitro-2-oxo-1H-quinoline-3-carboxylic acid IUPAC Name: 6-[2-[[(4-carboxy-2-fluorophenyl)carbamoylamino]methyl]imidazol-1-yl]-7-nitro-2-oxo-1H-quinoline-3-carboxylic acid Traditional Name: 6-[2-[[(4-carboxy-2-fluoro-phenyl)carbamoylamino]methyl]imidazol-1-yl]-2-keto-7-nitro-1H-quinoline-3-carboxylic acid Formula: C22H15FN6O8 MolecularWeight: 510.388303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)F)NC(=O)NCC2=NC=CN2C3=C(C=C4C(=C3)C=C(C(=O)N4)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)F)NC(=O)NCC2=NC=CN2C3=C(C=C4C(=C3)C=C(C(=O)N4)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C22H15FN6O8/c23-13-6-10(20(31)32)1-2-14(13)27-22(35)25-9-18-24-3-4-28(18)16-7-11-5-12(21(33)34)19(30)26-15(11)8-17(16)29(36)37/h1-8H,9H2,(H,26,30)(H,31,32)(H,33,34)(H2,25,27,35)