[4-bromanyl-2-[(E)-(naphthalen-1-ylcarbonylhydrazinylidene)methyl]phenyl] 4-methylbenzenesulfonate

Systemtic Name: [4-bromanyl-2-[(E)-(naphthalen-1-ylcarbonylhydrazinylidene)methyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [4-bromo-2-[(E)-(naphthalene-1-carbonylhydrazono)methyl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-bromo-2-[(E)-[[1-naphthalenyl(oxo)methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-(naphthalene-1-carbonylhydrazinylidene)methyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [4-bromo-2-[(E)-(1-naphthoylhydrazono)methyl]phenyl] ester Formula: C25H19BrN2O4S MolecularWeight: 523.39836

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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=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)Br)/C=N/NC(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H19BrN2O4S/c1-17-9-12-21(13-10-17)33(30,31)32-24-14-11-20(26)15-19(24)16-27-28-25(29)23-8-4-6-18-5-2-3-7-22(18)23/h2-16H,1H3,(H,28,29)/b27-16+