ethyl 4-(5-bromanyl-2-methoxy-phenyl)sulfonyloxy-1-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-(5-bromanyl-2-methoxy-phenyl)sulfonyloxy-1-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-(5-bromo-2-methoxy-phenyl)sulfonyloxy-6-oxo-1-(p-tolyl)pyridazine-3-carboxylate CAS Name: 4-(5-bromo-2-methoxyphenyl)sulfonyloxy-1-(4-methylphenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(5-bromo-2-methoxyphenyl)sulfonyloxy-1-(4-methylphenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-(5-bromo-2-methoxy-phenyl)sulfonyloxy-6-keto-1-(p-tolyl)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=C(C=CC(=C2)Br)OC)C3=CC=C(C=C3)C

Isomeric SMILES

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

InChI

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