[4-[[2-(4-fluoranylphenoxy)ethanoylhydrazinylidene]methyl]-2-methoxy-phenyl] 2,5-dimethylbenzenesulfonate

Systemtic Name: [4-[[2-(4-fluoranylphenoxy)ethanoylhydrazinylidene]methyl]-2-methoxy-phenyl] 2,5-dimethylbenzenesulfonate Openeye Name: [4-[[[2-(4-fluorophenoxy)acetyl]hydrazono]methyl]-2-methoxy-phenyl] 2,5-dimethylbenzenesulfonate CAS Name: 2,5-dimethylbenzenesulfonic acid [4-[[[2-(4-fluorophenoxy)-1-oxoethyl]hydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[[[2-(4-fluorophenoxy)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 2,5-dimethylbenzenesulfonate Traditional Name: 2,5-dimethylbenzenesulfonic acid [4-[[[2-(4-fluorophenoxy)acetyl]hydrazono]methyl]-2-methoxy-phenyl] ester Formula: C24H23FN2O6S MolecularWeight: 486.512623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=C(C=C(C=C2)C=NNC(=O)COC3=CC=C(C=C3)F)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=C(C=C(C=C2)C=NNC(=O)COC3=CC=C(C=C3)F)OC

InChI

InChI=1S/C24H23FN2O6S/c1-16-4-5-17(2)23(12-16)34(29,30)33-21-11-6-18(13-22(21)31-3)14-26-27-24(28)15-32-20-9-7-19(25)8-10-20/h4-14H,15H2,1-3H3,(H,27,28)