methyl 4-(4-bromophenyl)sulfonyloxy-1-(4-chlorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: methyl 4-(4-bromophenyl)sulfonyloxy-1-(4-chlorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: methyl 4-(4-bromophenyl)sulfonyloxy-1-(4-chlorophenyl)-6-oxo-pyridazine-3-carboxylate CAS Name: 4-(4-bromophenyl)sulfonyloxy-1-(4-chlorophenyl)-6-oxo-3-pyridazinecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-bromophenyl)sulfonyloxy-1-(4-chlorophenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-brosyloxy-1-(4-chlorophenyl)-6-keto-pyridazine-3-carboxylic acid methyl ester Formula: C18H12BrClN2O6S MolecularWeight: 499.71968

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(C(=O)C=C1OS(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=NN(C(=O)C=C1OS(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H12BrClN2O6S/c1-27-18(24)17-15(28-29(25,26)14-8-2-11(19)3-9-14)10-16(23)22(21-17)13-6-4-12(20)5-7-13/h2-10H,1H3