8-chloranyl-5-oxidanylidene-9-(1,2,4-triazol-4-yl)-3H-pyrazolo[1,5-c]quinazoline-2-carboxylic acid

Systemtic Name: 8-chloranyl-5-oxidanylidene-9-(1,2,4-triazol-4-yl)-3H-pyrazolo[1,5-c]quinazoline-2-carboxylic acid Openeye Name: 8-chloro-5-oxo-9-(1,2,4-triazol-4-yl)-3H-pyrazolo[1,5-c]quinazoline-2-carboxylic acid CAS Name: 8-chloro-5-oxo-9-(1,2,4-triazol-4-yl)-3H-pyrazolo[1,5-c]quinazoline-2-carboxylic acid IUPAC Name: 8-chloro-5-oxo-9-(1,2,4-triazol-4-yl)-3H-pyrazolo[1,5-c]quinazoline-2-carboxylic acid Traditional Name: 8-chloro-5-keto-9-(1,2,4-triazol-4-yl)-3H-pyrazolo[1,5-c]quinazoline-2-carboxylic acid Formula: C13H7ClN6O3 MolecularWeight: 330.68608

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC2=NC(=O)N3C(=C21)C=C(N3)C(=O)O)Cl)N4C=NN=C4

Isomeric SMILES

C1=C(C(=CC2=NC(=O)N3C(=C21)C=C(N3)C(=O)O)Cl)N4C=NN=C4

InChI

InChI=1S/C13H7ClN6O3/c14-7-2-8-6(1-11(7)19-4-15-16-5-19)10-3-9(12(21)22)18-20(10)13(23)17-8/h1-5,18H,(H,21,22)