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

Systemtic Name: 8-chloranyl-1,9-dinitro-5-oxidanylidene-3H-pyrazolo[1,5-c]quinazoline-2-carboxylic acid Openeye Name: 8-chloro-1,9-dinitro-5-oxo-3H-pyrazolo[1,5-c]quinazoline-2-carboxylic acid CAS Name: 8-chloro-1,9-dinitro-5-oxo-3H-pyrazolo[1,5-c]quinazoline-2-carboxylic acid IUPAC Name: 8-chloro-1,9-dinitro-5-oxo-3H-pyrazolo[1,5-c]quinazoline-2-carboxylic acid Traditional Name: 8-chloro-5-keto-1,9-dinitro-3H-pyrazolo[1,5-c]quinazoline-2-carboxylic acid Formula: C11H4ClN5O7 MolecularWeight: 353.63176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H4ClN5O7/c12-4-2-5-3(1-6(4)16(21)22)8-9(17(23)24)7(10(18)19)14-15(8)11(20)13-5/h1-2,14H,(H,18,19)