methyl 4-[[(6-methyl-4-oxidanylidene-1-phenyl-pyridazin-3-yl)carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[(6-methyl-4-oxidanylidene-1-phenyl-pyridazin-3-yl)carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[(6-methyl-4-oxo-1-phenyl-pyridazine-3-carbonyl)amino]methyl]benzoate CAS Name: 4-[[[(6-methyl-4-oxo-1-phenyl-3-pyridazinyl)-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(6-methyl-4-oxo-1-phenylpyridazine-3-carbonyl)amino]methyl]benzoate Traditional Name: 4-[[(4-keto-6-methyl-1-phenyl-pyridazine-3-carbonyl)amino]methyl]benzoic acid methyl ester Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H19N3O4/c1-14-12-18(25)19(23-24(14)17-6-4-3-5-7-17)20(26)22-13-15-8-10-16(11-9-15)21(27)28-2/h3-12H,13H2,1-2H3,(H,22,26)