[4-[(E)-[(5-bromanyl-2-methoxy-phenyl)carbonylhydrazinylidene]methyl]phenyl] benzenesulfonate

Systemtic Name: [4-[(E)-[(5-bromanyl-2-methoxy-phenyl)carbonylhydrazinylidene]methyl]phenyl] benzenesulfonate Openeye Name: [4-[(E)-[(5-bromo-2-methoxy-benzoyl)hydrazono]methyl]phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [4-[(E)-[[(5-bromo-2-methoxyphenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(5-bromo-2-methoxybenzoyl)hydrazinylidene]methyl]phenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [4-[(E)-[(5-bromo-2-methoxy-benzoyl)hydrazono]methyl]phenyl] ester Formula: C21H17BrN2O5S MolecularWeight: 489.33908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(=O)NN=CC2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H17BrN2O5S/c1-28-20-12-9-16(22)13-19(20)21(25)24-23-14-15-7-10-17(11-8-15)29-30(26,27)18-5-3-2-4-6-18/h2-14H,1H3,(H,24,25)/b23-14+