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

Systemtic Name: [2-bromanyl-4-[(E)-[(2-bromophenyl)carbonylhydrazinylidene]methyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [2-bromo-4-[(E)-[(2-bromobenzoyl)hydrazono]methyl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-bromo-4-[(E)-[[(2-bromophenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-bromo-4-[(E)-[(2-bromobenzoyl)hydrazinylidene]methyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-bromo-4-[(E)-[(2-bromobenzoyl)hydrazono]methyl]phenyl] ester Formula: C21H16Br2N2O4S MolecularWeight: 552.23574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)C=NNC(=O)C3=CC=CC=C3Br)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)/C=N/NC(=O)C3=CC=CC=C3Br)Br

InChI

InChI=1S/C21H16Br2N2O4S/c1-14-6-9-16(10-7-14)30(27,28)29-20-11-8-15(12-19(20)23)13-24-25-21(26)17-4-2-3-5-18(17)22/h2-13H,1H3,(H,25,26)/b24-13+