[4-[(E)-[(4-chlorophenyl)carbonylhydrazinylidene]methyl]phenyl] 4-nitrobenzenesulfonate

Systemtic Name: [4-[(E)-[(4-chlorophenyl)carbonylhydrazinylidene]methyl]phenyl] 4-nitrobenzenesulfonate Openeye Name: [4-[(E)-[(4-chlorobenzoyl)hydrazono]methyl]phenyl] 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid [4-[(E)-[[(4-chlorophenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(4-chlorobenzoyl)hydrazinylidene]methyl]phenyl] 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid [4-[(E)-[(4-chlorobenzoyl)hydrazono]methyl]phenyl] ester Formula: C20H14ClN3O6S MolecularWeight: 459.85966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=NNC(=O)C2=CC=C(C=C2)Cl)OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C20H14ClN3O6S/c21-16-5-3-15(4-6-16)20(25)23-22-13-14-1-9-18(10-2-14)30-31(28,29)19-11-7-17(8-12-19)24(26)27/h1-13H,(H,23,25)/b22-13+