ethyl 1-(4-methylphenyl)-6-oxidanylidene-4-(4-phenoxyphenyl)sulfonyloxy-pyridazine-3-carboxylate

Systemtic Name: ethyl 1-(4-methylphenyl)-6-oxidanylidene-4-(4-phenoxyphenyl)sulfonyloxy-pyridazine-3-carboxylate Openeye Name: ethyl 6-oxo-4-(4-phenoxyphenyl)sulfonyloxy-1-(p-tolyl)pyridazine-3-carboxylate CAS Name: 1-(4-methylphenyl)-6-oxo-4-(4-phenoxyphenyl)sulfonyloxy-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methylphenyl)-6-oxo-4-(4-phenoxyphenyl)sulfonyloxypyridazine-3-carboxylate Traditional Name: 6-keto-4-(4-phenoxyphenyl)sulfonyloxy-1-(p-tolyl)pyridazine-3-carboxylic acid ethyl ester Formula: C26H22N2O7S MolecularWeight: 506.52708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1OS(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1OS(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)C4=CC=C(C=C4)C

InChI

InChI=1S/C26H22N2O7S/c1-3-33-26(30)25-23(17-24(29)28(27-25)19-11-9-18(2)10-12-19)35-36(31,32)22-15-13-21(14-16-22)34-20-7-5-4-6-8-20/h4-17H,3H2,1-2H3