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

Systemtic Name: methyl 1-(4-chlorophenyl)-6-oxidanylidene-4-(phenylsulfonyloxy)pyridazine-3-carboxylate Openeye Name: methyl 4-(benzenesulfonyloxy)-1-(4-chlorophenyl)-6-oxo-pyridazine-3-carboxylate CAS Name: 4-(benzenesulfonyloxy)-1-(4-chlorophenyl)-6-oxo-3-pyridazinecarboxylic acid methyl ester IUPAC Name: methyl 4-(benzenesulfonyloxy)-1-(4-chlorophenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-besyloxy-1-(4-chlorophenyl)-6-keto-pyridazine-3-carboxylic acid methyl ester Formula: C18H13ClN2O6S MolecularWeight: 420.82362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13ClN2O6S/c1-26-18(23)17-15(27-28(24,25)14-5-3-2-4-6-14)11-16(22)21(20-17)13-9-7-12(19)8-10-13/h2-11H,1H3