[4-bromanyl-2-[(E)-[2-(phenylsulfonylamino)ethanoylhydrazinylidene]methyl]phenyl] benzoate

Systemtic Name: [4-bromanyl-2-[(E)-[2-(phenylsulfonylamino)ethanoylhydrazinylidene]methyl]phenyl] benzoate Openeye Name: [2-[(E)-[[2-(benzenesulfonamido)acetyl]hydrazono]methyl]-4-bromo-phenyl] benzoate CAS Name: benzoic acid [2-[(E)-[[2-(benzenesulfonamido)-1-oxoethyl]hydrazinylidene]methyl]-4-bromophenyl] ester IUPAC Name: [2-[(E)-[[2-(benzenesulfonamido)acetyl]hydrazinylidene]methyl]-4-bromophenyl] benzoate Traditional Name: benzoic acid [2-[(E)-[[2-(benzenesulfonamido)acetyl]hydrazono]methyl]-4-bromo-phenyl] ester Formula: C22H18BrN3O5S MolecularWeight: 516.36442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)C=NNC(=O)CNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)/C=N/NC(=O)CNS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H18BrN3O5S/c23-18-11-12-20(31-22(28)16-7-3-1-4-8-16)17(13-18)14-24-26-21(27)15-25-32(29,30)19-9-5-2-6-10-19/h1-14,25H,15H2,(H,26,27)/b24-14+