[3-[(E)-[(4-chlorophenyl)carbonylhydrazinylidene]methyl]phenyl] 4-methylbenzenesulfonate

Systemtic Name: [3-[(E)-[(4-chlorophenyl)carbonylhydrazinylidene]methyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [3-[(E)-[(4-chlorobenzoyl)hydrazono]methyl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3-[(E)-[[(4-chlorophenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [3-[(E)-[(4-chlorobenzoyl)hydrazinylidene]methyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [3-[(E)-[(4-chlorobenzoyl)hydrazono]methyl]phenyl] ester Formula: C21H17ClN2O4S MolecularWeight: 428.88868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)C=NNC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)/C=N/NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H17ClN2O4S/c1-15-5-11-20(12-6-15)29(26,27)28-19-4-2-3-16(13-19)14-23-24-21(25)17-7-9-18(22)10-8-17/h2-14H,1H3,(H,24,25)/b23-14+