9-[(4-carboxyphenyl)carbamoylamino]-8-chloranyl-5-oxidanylidene-3H-pyrazolo[1,5-c]quinazoline-1,2-dicarboxylic acid

Systemtic Name: 9-[(4-carboxyphenyl)carbamoylamino]-8-chloranyl-5-oxidanylidene-3H-pyrazolo[1,5-c]quinazoline-1,2-dicarboxylic acid Openeye Name: 9-[(4-carboxyphenyl)carbamoylamino]-8-chloro-5-oxo-3H-pyrazolo[1,5-c]quinazoline-1,2-dicarboxylic acid CAS Name: 9-[[(4-carboxyanilino)-oxomethyl]amino]-8-chloro-5-oxo-3H-pyrazolo[1,5-c]quinazoline-1,2-dicarboxylic acid IUPAC Name: 9-[(4-carboxyphenyl)carbamoylamino]-8-chloro-5-oxo-3H-pyrazolo[1,5-c]quinazoline-1,2-dicarboxylic acid Traditional Name: 9-[(4-carboxyphenyl)carbamoylamino]-8-chloro-5-keto-3H-pyrazolo[1,5-c]quinazoline-1,2-dicarboxylic acid Formula: C20H12ClN5O8 MolecularWeight: 485.79098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NC(=O)NC2=CC3=C4C(=C(NN4C(=O)N=C3C=C2Cl)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NC(=O)NC2=CC3=C4C(=C(NN4C(=O)N=C3C=C2Cl)C(=O)O)C(=O)O

InChI

InChI=1S/C20H12ClN5O8/c21-10-6-11-9(15-13(17(29)30)14(18(31)32)25-26(15)20(34)24-11)5-12(10)23-19(33)22-8-3-1-7(2-4-8)16(27)28/h1-6,25H,(H,27,28)(H,29,30)(H,31,32)(H2,22,23,33)