8-chloranyl-5-oxidanylidene-9-pyrrol-1-yl-3H-pyrazolo[1,5-c]quinazoline-1,2-dicarboxylic acid

Systemtic Name: 8-chloranyl-5-oxidanylidene-9-pyrrol-1-yl-3H-pyrazolo[1,5-c]quinazoline-1,2-dicarboxylic acid Openeye Name: 8-chloro-5-oxo-9-pyrrol-1-yl-3H-pyrazolo[1,5-c]quinazoline-1,2-dicarboxylic acid CAS Name: 8-chloro-5-oxo-9-(1-pyrrolyl)-3H-pyrazolo[1,5-c]quinazoline-1,2-dicarboxylic acid IUPAC Name: 8-chloro-5-oxo-9-pyrrol-1-yl-3H-pyrazolo[1,5-c]quinazoline-1,2-dicarboxylic acid Traditional Name: 8-chloro-5-keto-9-pyrrol-1-yl-3H-pyrazolo[1,5-c]quinazoline-1,2-dicarboxylic acid Formula: C16H9ClN4O5 MolecularWeight: 372.71946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=CC3=C4C(=C(NN4C(=O)N=C3C=C2Cl)C(=O)O)C(=O)O

Isomeric SMILES

C1=CN(C=C1)C2=CC3=C4C(=C(NN4C(=O)N=C3C=C2Cl)C(=O)O)C(=O)O

InChI

InChI=1S/C16H9ClN4O5/c17-8-6-9-7(5-10(8)20-3-1-2-4-20)13-11(14(22)23)12(15(24)25)19-21(13)16(26)18-9/h1-6,19H,(H,22,23)(H,24,25)