6-(4-methylphenyl)-2-(2-methylpropyl)-3-oxidanylidene-pyridazine-4-carboxylic acid

Systemtic Name: 6-(4-methylphenyl)-2-(2-methylpropyl)-3-oxidanylidene-pyridazine-4-carboxylic acid Openeye Name: 2-isobutyl-3-oxo-6-(p-tolyl)pyridazine-4-carboxylic acid CAS Name: 6-(4-methylphenyl)-2-(2-methylpropyl)-3-oxo-4-pyridazinecarboxylic acid IUPAC Name: 6-(4-methylphenyl)-2-(2-methylpropyl)-3-oxopyridazine-4-carboxylic acid Traditional Name: 2-isobutyl-3-keto-6-(p-tolyl)pyridazine-4-carboxylic acid Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C(=C2)C(=O)O)CC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C(=C2)C(=O)O)CC(C)C

InChI

InChI=1S/C16H18N2O3/c1-10(2)9-18-15(19)13(16(20)21)8-14(17-18)12-6-4-11(3)5-7-12/h4-8,10H,9H2,1-3H3,(H,20,21)