ethyl 4-(4-butoxyphenyl)sulfonyloxy-1-(2-chlorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-(4-butoxyphenyl)sulfonyloxy-1-(2-chlorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-(4-butoxyphenyl)sulfonyloxy-1-(2-chlorophenyl)-6-oxo-pyridazine-3-carboxylate CAS Name: 4-(4-butoxyphenyl)sulfonyloxy-1-(2-chlorophenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-butoxyphenyl)sulfonyloxy-1-(2-chlorophenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-(4-butoxyphenyl)sulfonyloxy-1-(2-chlorophenyl)-6-keto-pyridazine-3-carboxylic acid ethyl ester Formula: C23H23ClN2O7S MolecularWeight: 506.95592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=O)N(N=C2C(=O)OCC)C3=CC=CC=C3Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=O)N(N=C2C(=O)OCC)C3=CC=CC=C3Cl

InChI

InChI=1S/C23H23ClN2O7S/c1-3-5-14-32-16-10-12-17(13-11-16)34(29,30)33-20-15-21(27)26(19-9-7-6-8-18(19)24)25-22(20)23(28)31-4-2/h6-13,15H,3-5,14H2,1-2H3