[4-[(E)-[(2-bromophenyl)carbonylhydrazinylidene]methyl]-2-ethoxy-phenyl] 4-nitrobenzenesulfonate

Systemtic Name: [4-[(E)-[(2-bromophenyl)carbonylhydrazinylidene]methyl]-2-ethoxy-phenyl] 4-nitrobenzenesulfonate Openeye Name: [4-[(E)-[(2-bromobenzoyl)hydrazono]methyl]-2-ethoxy-phenyl] 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid [4-[(E)-[[(2-bromophenyl)-oxomethyl]hydrazinylidene]methyl]-2-ethoxyphenyl] ester IUPAC Name: [4-[(E)-[(2-bromobenzoyl)hydrazinylidene]methyl]-2-ethoxyphenyl] 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid [4-[(E)-[(2-bromobenzoyl)hydrazono]methyl]-2-ethoxy-phenyl] ester Formula: C22H18BrN3O7S MolecularWeight: 548.36322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NNC(=O)C2=CC=CC=C2Br)OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=N/NC(=O)C2=CC=CC=C2Br)OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H18BrN3O7S/c1-2-32-21-13-15(14-24-25-22(27)18-5-3-4-6-19(18)23)7-12-20(21)33-34(30,31)17-10-8-16(9-11-17)26(28)29/h3-14H,2H2,1H3,(H,25,27)/b24-14+