[4-bromanyl-2-[(E)-[(4-methylphenyl)sulfonylhydrazinylidene]methyl]phenyl] 4-chloranylbenzoate

Systemtic Name: [4-bromanyl-2-[(E)-[(4-methylphenyl)sulfonylhydrazinylidene]methyl]phenyl] 4-chloranylbenzoate Openeye Name: [4-bromo-2-[(E)-(p-tolylsulfonylhydrazono)methyl]phenyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [4-bromo-2-[(E)-[(4-methylphenyl)sulfonylhydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-[(4-methylphenyl)sulfonylhydrazinylidene]methyl]phenyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [4-bromo-2-[(E)-(tosylhydrazono)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)NN=CC2=C(C=CC(=C2)Br)OC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

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

InChI

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