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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=NN(C(=O)C=C2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=NN(C(=O)C=C2)CC3=CC=CC=C3

InChI

InChI=1S/C21H19N3O4/c1-28-21(27)17-9-7-15(8-10-17)13-22-20(26)18-11-12-19(25)24(23-18)14-16-5-3-2-4-6-16/h2-12H,13-14H2,1H3,(H,22,26)