[4-bromanyl-2-[(E)-[(2-bromophenyl)carbonylhydrazinylidene]methyl]phenyl] 4-nitrobenzenesulfonate

Systemtic Name: [4-bromanyl-2-[(E)-[(2-bromophenyl)carbonylhydrazinylidene]methyl]phenyl] 4-nitrobenzenesulfonate Openeye Name: [4-bromo-2-[(E)-[(2-bromobenzoyl)hydrazono]methyl]phenyl] 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid [4-bromo-2-[(E)-[[(2-bromophenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-[(2-bromobenzoyl)hydrazinylidene]methyl]phenyl] 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid [4-bromo-2-[(E)-[(2-bromobenzoyl)hydrazono]methyl]phenyl] ester Formula: C20H13Br2N3O6S MolecularWeight: 583.20672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NN=CC2=C(C=CC(=C2)Br)OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N/N=C/C2=C(C=CC(=C2)Br)OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C20H13Br2N3O6S/c21-14-5-10-19(31-32(29,30)16-8-6-15(7-9-16)25(27)28)13(11-14)12-23-24-20(26)17-3-1-2-4-18(17)22/h1-12H,(H,24,26)/b23-12+