diethyl 8-chloranyl-9-(3-methanoylpyrrol-1-yl)-5-oxidanylidene-3H-pyrazolo[1,5-c]quinazoline-1,2-dicarboxylate

Systemtic Name: diethyl 8-chloranyl-9-(3-methanoylpyrrol-1-yl)-5-oxidanylidene-3H-pyrazolo[1,5-c]quinazoline-1,2-dicarboxylate Openeye Name: diethyl 8-chloro-9-(3-formylpyrrol-1-yl)-5-oxo-3H-pyrazolo[1,5-c]quinazoline-1,2-dicarboxylate CAS Name: 8-chloro-9-(3-formyl-1-pyrrolyl)-5-oxo-3H-pyrazolo[1,5-c]quinazoline-1,2-dicarboxylic acid diethyl ester IUPAC Name: diethyl 8-chloro-9-(3-formylpyrrol-1-yl)-5-oxo-3H-pyrazolo[1,5-c]quinazoline-1,2-dicarboxylate Traditional Name: 8-chloro-9-(3-formylpyrrol-1-yl)-5-keto-3H-pyrazolo[1,5-c]quinazoline-1,2-dicarboxylic acid diethyl ester Formula: C21H17ClN4O6 MolecularWeight: 456.83588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN2C1=C3C=C(C(=CC3=NC2=O)Cl)N4C=CC(=C4)C=O)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(NN2C1=C3C=C(C(=CC3=NC2=O)Cl)N4C=CC(=C4)C=O)C(=O)OCC

InChI

InChI=1S/C21H17ClN4O6/c1-3-31-19(28)16-17(20(29)32-4-2)24-26-18(16)12-7-15(25-6-5-11(9-25)10-27)13(22)8-14(12)23-21(26)30/h5-10,24H,3-4H2,1-2H3