ethyl 4-[(2-chloranyl-6-fluoranyl-phenyl)carbonylamino]-1-(2-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-[(2-chloranyl-6-fluoranyl-phenyl)carbonylamino]-1-(2-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-[(2-chloro-6-fluoro-benzoyl)amino]-1-(o-tolyl)-6-oxo-pyridazine-3-carboxylate CAS Name: 4-[[(2-chloro-6-fluorophenyl)-oxomethyl]amino]-1-(2-methylphenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2-chloro-6-fluorobenzoyl)amino]-1-(2-methylphenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-[(2-chloro-6-fluoro-benzoyl)amino]-6-keto-1-(o-tolyl)pyridazine-3-carboxylic acid ethyl ester Formula: C21H17ClFN3O4 MolecularWeight: 429.828783

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)C2=C(C=CC=C2Cl)F)C3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)C2=C(C=CC=C2Cl)F)C3=CC=CC=C3C

InChI

InChI=1S/C21H17ClFN3O4/c1-3-30-21(29)19-15(24-20(28)18-13(22)8-6-9-14(18)23)11-17(27)26(25-19)16-10-5-4-7-12(16)2/h4-11H,3H2,1-2H3,(H,24,28)