2-[4-[acridin-9-ylcarbonyl-(4-methylphenyl)sulfonyl-amino]phenyl]ethanoic acid hydrobromide

Systemtic Name: 2-[4-[acridin-9-ylcarbonyl-(4-methylphenyl)sulfonyl-amino]phenyl]ethanoic acid hydrobromide Openeye Name: 2-[4-[acridine-9-carbonyl(p-tolylsulfonyl)amino]phenyl]acetic acid hydrobromide CAS Name: 2-[4-[[9-acridinyl(oxo)methyl]-(4-methylphenyl)sulfonylamino]phenyl]acetic acid hydrobromide IUPAC Name: 2-[4-[acridine-9-carbonyl-(4-methylphenyl)sulfonylamino]phenyl]acetic acid hydrobromide Traditional Name: 2-[4-[acridine-9-carbonyl(tosyl)amino]phenyl]acetic acid hydrobromide Formula: C29H23BrN2O5S MolecularWeight: 591.47232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC=C(C=C2)CC(=O)O)C(=O)C3=C4C=CC=CC4=NC5=CC=CC=C53.Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC=C(C=C2)CC(=O)O)C(=O)C3=C4C=CC=CC4=NC5=CC=CC=C53.Br

InChI

InChI=1S/C29H22N2O5S.BrH/c1-19-10-16-22(17-11-19)37(35,36)31(21-14-12-20(13-15-21)18-27(32)33)29(34)28-23-6-2-4-8-25(23)30-26-9-5-3-7-24(26)28;/h2-17H,18H2,1H3,(H,32,33);1H