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

Systemtic Name: methyl 3-[[1-(4-chlorophenyl)-6-methyl-4-oxidanylidene-pyridazin-3-yl]carbonylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[1-(4-chlorophenyl)-6-methyl-4-oxo-pyridazine-3-carbonyl]amino]-4-methyl-benzoate CAS Name: 3-[[[1-(4-chlorophenyl)-6-methyl-4-oxo-3-pyridazinyl]-oxomethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[1-(4-chlorophenyl)-6-methyl-4-oxopyridazine-3-carbonyl]amino]-4-methylbenzoate Traditional Name: 3-[[1-(4-chlorophenyl)-4-keto-6-methyl-pyridazine-3-carbonyl]amino]-4-methyl-benzoic acid methyl ester Formula: C21H18ClN3O4 MolecularWeight: 411.83832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=NN(C(=CC2=O)C)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=NN(C(=CC2=O)C)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H18ClN3O4/c1-12-4-5-14(21(28)29-3)11-17(12)23-20(27)19-18(26)10-13(2)25(24-19)16-8-6-15(22)7-9-16/h4-11H,1-3H3,(H,23,27)