[2-chloranyl-6-methoxy-4-[(E)-(phenylsulfonylhydrazinylidene)methyl]phenyl] benzenesulfonate

Systemtic Name: [2-chloranyl-6-methoxy-4-[(E)-(phenylsulfonylhydrazinylidene)methyl]phenyl] benzenesulfonate Openeye Name: [4-[(E)-(benzenesulfonylhydrazono)methyl]-2-chloro-6-methoxy-phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [4-[(E)-(benzenesulfonylhydrazinylidene)methyl]-2-chloro-6-methoxyphenyl] ester IUPAC Name: [4-[(E)-(benzenesulfonylhydrazinylidene)methyl]-2-chloro-6-methoxyphenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [4-[(E)-(besylhydrazono)methyl]-2-chloro-6-methoxy-phenyl] ester Formula: C20H17ClN2O6S2 MolecularWeight: 480.94178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNS(=O)(=O)C2=CC=CC=C2)Cl)OS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N/NS(=O)(=O)C2=CC=CC=C2)Cl)OS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H17ClN2O6S2/c1-28-19-13-15(14-22-23-30(24,25)16-8-4-2-5-9-16)12-18(21)20(19)29-31(26,27)17-10-6-3-7-11-17/h2-14,23H,1H3/b22-14+