ethyl 4-[[1-(4-bromophenyl)-4-oxidanylidene-pyridazin-3-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[1-(4-bromophenyl)-4-oxidanylidene-pyridazin-3-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[1-(4-bromophenyl)-4-oxo-pyridazine-3-carbonyl]amino]benzoate CAS Name: 4-[[[1-(4-bromophenyl)-4-oxo-3-pyridazinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[1-(4-bromophenyl)-4-oxopyridazine-3-carbonyl]amino]benzoate Traditional Name: 4-[[1-(4-bromophenyl)-4-keto-pyridazine-3-carbonyl]amino]benzoic acid ethyl ester Formula: C20H16BrN3O4 MolecularWeight: 442.26274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C=CC2=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C=CC2=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H16BrN3O4/c1-2-28-20(27)13-3-7-15(8-4-13)22-19(26)18-17(25)11-12-24(23-18)16-9-5-14(21)6-10-16/h3-12H,2H2,1H3,(H,22,26)