[4-bromanyl-2-[(E)-[(4-chlorophenyl)carbonylhydrazinylidene]methyl]phenyl] 4-methylbenzenesulfonate

Systemtic Name: [4-bromanyl-2-[(E)-[(4-chlorophenyl)carbonylhydrazinylidene]methyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [4-bromo-2-[(E)-[(4-chlorobenzoyl)hydrazono]methyl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-bromo-2-[(E)-[[(4-chlorophenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-[(4-chlorobenzoyl)hydrazinylidene]methyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [4-bromo-2-[(E)-[(4-chlorobenzoyl)hydrazono]methyl]phenyl] ester Formula: C21H16BrClN2O4S MolecularWeight: 507.78474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16BrClN2O4S/c1-14-2-9-19(10-3-14)30(27,28)29-20-11-6-17(22)12-16(20)13-24-25-21(26)15-4-7-18(23)8-5-15/h2-13H,1H3,(H,25,26)/b24-13+