dimethyl 3-ethanoyl-5-oxidanylidene-2H-pyrazolo[5,1-a]isoindole-1,2-dicarboxylate

Systemtic Name: dimethyl 3-ethanoyl-5-oxidanylidene-2H-pyrazolo[5,1-a]isoindole-1,2-dicarboxylate Openeye Name: dimethyl 3-acetyl-5-oxo-2H-pyrazolo[5,1-a]isoindole-1,2-dicarboxylate CAS Name: 3-acetyl-5-oxo-2H-pyrazolo[5,1-a]isoindole-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-acetyl-5-oxo-2H-pyrazolo[5,1-a]isoindole-1,2-dicarboxylate Traditional Name: 3-acetyl-5-keto-2H-pyrazol[5,1-a]isoindole-1,2-dicarboxylic acid dimethyl ester Formula: C16H14N2O6 MolecularWeight: 330.29216

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(C(=C2N1C(=O)C3=CC=CC=C32)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(=O)N1C(C(=C2N1C(=O)C3=CC=CC=C32)C(=O)OC)C(=O)OC

InChI

InChI=1S/C16H14N2O6/c1-8(19)17-13(16(22)24-3)11(15(21)23-2)12-9-6-4-5-7-10(9)14(20)18(12)17/h4-7,13H,1-3H3