[5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl 1-methyl-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: [5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl 1-methyl-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: [5-(p-tolyl)isoxazol-3-yl]methyl 1-methyl-6-oxo-pyridazine-3-carboxylate CAS Name: 1-methyl-6-oxo-3-pyridazinecarboxylic acid [5-(4-methylphenyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl 1-methyl-6-oxopyridazine-3-carboxylate Traditional Name: 6-keto-1-methyl-pyridazine-3-carboxylic acid [5-(p-tolyl)isoxazol-3-yl]methyl ester Formula: C17H15N3O4 MolecularWeight: 325.3187

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NO2)COC(=O)C3=NN(C(=O)C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NO2)COC(=O)C3=NN(C(=O)C=C3)C

InChI

InChI=1S/C17H15N3O4/c1-11-3-5-12(6-4-11)15-9-13(19-24-15)10-23-17(22)14-7-8-16(21)20(2)18-14/h3-9H,10H2,1-2H3