ethyl 4-[2-(4-bromophenyl)ethanoylamino]-6-oxidanylidene-1-phenyl-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-[2-(4-bromophenyl)ethanoylamino]-6-oxidanylidene-1-phenyl-pyridazine-3-carboxylate Openeye Name: ethyl 4-[[2-(4-bromophenyl)acetyl]amino]-6-oxo-1-phenyl-pyridazine-3-carboxylate CAS Name: 4-[[2-(4-bromophenyl)-1-oxoethyl]amino]-6-oxo-1-phenyl-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-bromophenyl)acetyl]amino]-6-oxo-1-phenylpyridazine-3-carboxylate Traditional Name: 4-[[2-(4-bromophenyl)acetyl]amino]-6-keto-1-phenyl-pyridazine-3-carboxylic acid ethyl ester Formula: C21H18BrN3O4 MolecularWeight: 456.28932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)CC2=CC=C(C=C2)Br)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)CC2=CC=C(C=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C21H18BrN3O4/c1-2-29-21(28)20-17(23-18(26)12-14-8-10-15(22)11-9-14)13-19(27)25(24-20)16-6-4-3-5-7-16/h3-11,13H,2,12H2,1H3,(H,23,26)