6-[2-[[(4-carboxyphenyl)carbamoylamino]methyl]imidazol-1-yl]-7-chloranyl-2-oxidanylidene-1H-quinoline-3-carboxylic acid

Systemtic Name: 6-[2-[[(4-carboxyphenyl)carbamoylamino]methyl]imidazol-1-yl]-7-chloranyl-2-oxidanylidene-1H-quinoline-3-carboxylic acid Openeye Name: 6-[2-[[(4-carboxyphenyl)carbamoylamino]methyl]imidazol-1-yl]-7-chloro-2-oxo-1H-quinoline-3-carboxylic acid CAS Name: 6-[2-[[[(4-carboxyanilino)-oxomethyl]amino]methyl]-1-imidazolyl]-7-chloro-2-oxo-1H-quinoline-3-carboxylic acid IUPAC Name: 6-[2-[[(4-carboxyphenyl)carbamoylamino]methyl]imidazol-1-yl]-7-chloro-2-oxo-1H-quinoline-3-carboxylic acid Traditional Name: 6-[2-[[(4-carboxyphenyl)carbamoylamino]methyl]imidazol-1-yl]-7-chloro-2-keto-1H-quinoline-3-carboxylic acid Formula: C22H16ClN5O6 MolecularWeight: 481.84534

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NC(=O)NCC2=NC=CN2C3=C(C=C4C(=C3)C=C(C(=O)N4)C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NC(=O)NCC2=NC=CN2C3=C(C=C4C(=C3)C=C(C(=O)N4)C(=O)O)Cl

InChI

InChI=1S/C22H16ClN5O6/c23-15-9-16-12(7-14(21(32)33)19(29)27-16)8-17(15)28-6-5-24-18(28)10-25-22(34)26-13-3-1-11(2-4-13)20(30)31/h1-9H,10H2,(H,27,29)(H,30,31)(H,32,33)(H2,25,26,34)