ethyl 1-(3-bromophenyl)-4-(4-methoxy-3-methyl-phenyl)sulfonyloxy-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 1-(3-bromophenyl)-4-(4-methoxy-3-methyl-phenyl)sulfonyloxy-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 1-(3-bromophenyl)-4-(4-methoxy-3-methyl-phenyl)sulfonyloxy-6-oxo-pyridazine-3-carboxylate CAS Name: 1-(3-bromophenyl)-4-(4-methoxy-3-methylphenyl)sulfonyloxy-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-bromophenyl)-4-(4-methoxy-3-methylphenyl)sulfonyloxy-6-oxopyridazine-3-carboxylate Traditional Name: 1-(3-bromophenyl)-6-keto-4-(4-methoxy-3-methyl-phenyl)sulfonyloxy-pyridazine-3-carboxylic acid ethyl ester Formula: C21H19BrN2O7S MolecularWeight: 523.35376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1OS(=O)(=O)C2=CC(=C(C=C2)OC)C)C3=CC(=CC=C3)Br

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1OS(=O)(=O)C2=CC(=C(C=C2)OC)C)C3=CC(=CC=C3)Br

InChI

InChI=1S/C21H19BrN2O7S/c1-4-30-21(26)20-18(12-19(25)24(23-20)15-7-5-6-14(22)11-15)31-32(27,28)16-8-9-17(29-3)13(2)10-16/h5-12H,4H2,1-3H3