[2-bromanyl-4-[(E)-[(2-oxidanyl-2,2-diphenyl-ethanoyl)hydrazinylidene]methyl]phenyl] 4-methoxybenzenesulfonate

Systemtic Name: [2-bromanyl-4-[(E)-[(2-oxidanyl-2,2-diphenyl-ethanoyl)hydrazinylidene]methyl]phenyl] 4-methoxybenzenesulfonate Openeye Name: [2-bromo-4-[(E)-[(2-hydroxy-2,2-diphenyl-acetyl)hydrazono]methyl]phenyl] 4-methoxybenzenesulfonate CAS Name: 4-methoxybenzenesulfonic acid [2-bromo-4-[(E)-[(2-hydroxy-1-oxo-2,2-diphenylethyl)hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-bromo-4-[(E)-[(2-hydroxy-2,2-diphenylacetyl)hydrazinylidene]methyl]phenyl] 4-methoxybenzenesulfonate Traditional Name: 4-methoxybenzenesulfonic acid [4-[(E)-(benziloylhydrazono)methyl]-2-bromo-phenyl] ester Formula: C28H23BrN2O6S MolecularWeight: 595.46102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)C=NNC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)Br

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)/C=N/NC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)Br

InChI

InChI=1S/C28H23BrN2O6S/c1-36-23-13-15-24(16-14-23)38(34,35)37-26-17-12-20(18-25(26)29)19-30-31-27(32)28(33,21-8-4-2-5-9-21)22-10-6-3-7-11-22/h2-19,33H,1H3,(H,31,32)/b30-19+