ethyl 1-(3-bromophenyl)-4-(4-methoxyphenyl)sulfonyloxy-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 1-(3-bromophenyl)-4-(4-methoxyphenyl)sulfonyloxy-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 1-(3-bromophenyl)-4-(4-methoxyphenyl)sulfonyloxy-6-oxo-pyridazine-3-carboxylate CAS Name: 1-(3-bromophenyl)-4-(4-methoxyphenyl)sulfonyloxy-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-bromophenyl)-4-(4-methoxyphenyl)sulfonyloxy-6-oxopyridazine-3-carboxylate Traditional Name: 1-(3-bromophenyl)-6-keto-4-(4-methoxyphenyl)sulfonyloxy-pyridazine-3-carboxylic acid ethyl ester Formula: C20H17BrN2O7S MolecularWeight: 509.32718

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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)C3=CC(=CC=C3)Br

Isomeric SMILES

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

InChI

InChI=1S/C20H17BrN2O7S/c1-3-29-20(25)19-17(30-31(26,27)16-9-7-15(28-2)8-10-16)12-18(24)23(22-19)14-6-4-5-13(21)11-14/h4-12H,3H2,1-2H3