[4-[(E)-[(4-chlorophenyl)carbonylhydrazinylidene]methyl]-2-methoxy-phenyl] benzenesulfonate

Systemtic Name: [4-[(E)-[(4-chlorophenyl)carbonylhydrazinylidene]methyl]-2-methoxy-phenyl] benzenesulfonate Openeye Name: [4-[(E)-[(4-chlorobenzoyl)hydrazono]methyl]-2-methoxy-phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [4-[(E)-[[(4-chlorophenyl)-oxomethyl]hydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-[(4-chlorobenzoyl)hydrazinylidene]methyl]-2-methoxyphenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [4-[(E)-[(4-chlorobenzoyl)hydrazono]methyl]-2-methoxy-phenyl] ester Formula: C21H17ClN2O5S MolecularWeight: 444.88808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17ClN2O5S/c1-28-20-13-15(14-23-24-21(25)16-8-10-17(22)11-9-16)7-12-19(20)29-30(26,27)18-5-3-2-4-6-18/h2-14H,1H3,(H,24,25)/b23-14+