8-chloranyl-9-nitro-5-oxidanylidene-3H-pyrazolo[1,5-c]quinazoline-2-carboxylic acid

Systemtic Name: 8-chloranyl-9-nitro-5-oxidanylidene-3H-pyrazolo[1,5-c]quinazoline-2-carboxylic acid Openeye Name: 8-chloro-9-nitro-5-oxo-3H-pyrazolo[1,5-c]quinazoline-2-carboxylic acid CAS Name: 8-chloro-9-nitro-5-oxo-3H-pyrazolo[1,5-c]quinazoline-2-carboxylic acid IUPAC Name: 8-chloro-9-nitro-5-oxo-3H-pyrazolo[1,5-c]quinazoline-2-carboxylic acid Traditional Name: 8-chloro-5-keto-9-nitro-3H-pyrazolo[1,5-c]quinazoline-2-carboxylic acid Formula: C11H5ClN4O5 MolecularWeight: 308.6342

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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)[N+](=O)[O-]

Isomeric SMILES

C1=C(C(=CC2=NC(=O)N3C(=C21)C=C(N3)C(=O)O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C11H5ClN4O5/c12-5-2-6-4(1-9(5)16(20)21)8-3-7(10(17)18)14-15(8)11(19)13-6/h1-3,14H,(H,17,18)