(4-methylphenyl)methyl 1-[(4-methylphenyl)methyl]-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: (4-methylphenyl)methyl 1-[(4-methylphenyl)methyl]-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: p-tolylmethyl 6-oxo-1-(p-tolylmethyl)pyridazine-3-carboxylate CAS Name: 1-[(4-methylphenyl)methyl]-6-oxo-3-pyridazinecarboxylic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl 1-[(4-methylphenyl)methyl]-6-oxopyridazine-3-carboxylate Traditional Name: 6-keto-1-(4-methylbenzyl)pyridazine-3-carboxylic acid (4-methylbenzyl) ester Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)C=CC(=N2)C(=O)OCC3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)C=CC(=N2)C(=O)OCC3=CC=C(C=C3)C

InChI

InChI=1S/C21H20N2O3/c1-15-3-7-17(8-4-15)13-23-20(24)12-11-19(22-23)21(25)26-14-18-9-5-16(2)6-10-18/h3-12H,13-14H2,1-2H3