[2-(2,5-diethylphenyl)-2-oxidanylidene-ethyl] 6-oxidanylidene-4,5-dihydro-1H-pyridazine-3-carboxylate

Systemtic Name: [2-(2,5-diethylphenyl)-2-oxidanylidene-ethyl] 6-oxidanylidene-4,5-dihydro-1H-pyridazine-3-carboxylate Openeye Name: [2-(2,5-diethylphenyl)-2-oxo-ethyl] 6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylate CAS Name: 6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylic acid [2-(2,5-diethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-diethylphenyl)-2-oxoethyl] 6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylate Traditional Name: 6-keto-4,5-dihydro-1H-pyridazine-3-carboxylic acid [2-(2,5-diethylphenyl)-2-keto-ethyl] ester Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)CC)C(=O)COC(=O)C2=NNC(=O)CC2

Isomeric SMILES

CCC1=CC(=C(C=C1)CC)C(=O)COC(=O)C2=NNC(=O)CC2

InChI

InChI=1S/C17H20N2O4/c1-3-11-5-6-12(4-2)13(9-11)15(20)10-23-17(22)14-7-8-16(21)19-18-14/h5-6,9H,3-4,7-8,10H2,1-2H3,(H,19,21)