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

Systemtic Name: [4-[(E)-[(4-chlorophenyl)carbonylhydrazinylidene]methyl]phenyl] 4-acetamidobenzenesulfonate Openeye Name: [4-[(E)-[(4-chlorobenzoyl)hydrazono]methyl]phenyl] 4-acetamidobenzenesulfonate CAS Name: 4-acetamidobenzenesulfonic acid [4-[(E)-[[(4-chlorophenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(4-chlorobenzoyl)hydrazinylidene]methyl]phenyl] 4-acetamidobenzenesulfonate Traditional Name: 4-acetamidobenzenesulfonic acid [4-[(E)-[(4-chlorobenzoyl)hydrazono]methyl]phenyl] ester Formula: C22H18ClN3O5S MolecularWeight: 471.91342

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C=NNC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)/C=N/NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H18ClN3O5S/c1-15(27)25-19-8-12-21(13-9-19)32(29,30)31-20-10-2-16(3-11-20)14-24-26-22(28)17-4-6-18(23)7-5-17/h2-14H,1H3,(H,25,27)(H,26,28)/b24-14+