methyl 4-(4-methylphenyl)carbonyl-5,6-bis(oxidanylidene)-1,2-dihydropyridazine-3-carboxylate

Systemtic Name: methyl 4-(4-methylphenyl)carbonyl-5,6-bis(oxidanylidene)-1,2-dihydropyridazine-3-carboxylate Openeye Name: methyl 4-(4-methylbenzoyl)-5,6-dioxo-1,2-dihydropyridazine-3-carboxylate CAS Name: 4-[(4-methylphenyl)-oxomethyl]-5,6-dioxo-1,2-dihydropyridazine-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(4-methylbenzoyl)-5,6-dioxo-1,2-dihydropyridazine-3-carboxylate Traditional Name: 5,6-diketo-4-p-toluoyl-1,2-dihydropyridazine-3-carboxylic acid methyl ester Formula: C14H12N2O5 MolecularWeight: 288.25548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=C(NNC(=O)C2=O)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C(NNC(=O)C2=O)C(=O)OC

InChI

InChI=1S/C14H12N2O5/c1-7-3-5-8(6-4-7)11(17)9-10(14(20)21-2)15-16-13(19)12(9)18/h3-6H,1-2H3,(H,15,18)(H,16,19)