5-[4-[acridin-9-ylcarbonyl-(4-methoxyphenyl)sulfamoyl]phenyl]pentanoic acid hydrobromide

Systemtic Name: 5-[4-[acridin-9-ylcarbonyl-(4-methoxyphenyl)sulfamoyl]phenyl]pentanoic acid hydrobromide Openeye Name: 5-[4-[acridine-9-carbonyl-(4-methoxyphenyl)sulfamoyl]phenyl]pentanoic acid hydrobromide CAS Name: 5-[4-[[9-acridinyl(oxo)methyl]-(4-methoxyphenyl)sulfamoyl]phenyl]pentanoic acid hydrobromide IUPAC Name: 5-[4-[acridine-9-carbonyl-(4-methoxyphenyl)sulfamoyl]phenyl]pentanoic acid hydrobromide Traditional Name: 5-[4-[acridine-9-carbonyl-(4-methoxyphenyl)sulfamoyl]phenyl]valeric acid hydrobromide Formula: C32H29BrN2O6S MolecularWeight: 649.55146

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(C(=O)C2=C3C=CC=CC3=NC4=CC=CC=C42)S(=O)(=O)C5=CC=C(C=C5)CCCCC(=O)O.Br

Isomeric SMILES

COC1=CC=C(C=C1)N(C(=O)C2=C3C=CC=CC3=NC4=CC=CC=C42)S(=O)(=O)C5=CC=C(C=C5)CCCCC(=O)O.Br

InChI

InChI=1S/C32H28N2O6S.BrH/c1-40-24-18-16-23(17-19-24)34(41(38,39)25-20-14-22(15-21-25)8-2-7-13-30(35)36)32(37)31-26-9-3-5-11-28(26)33-29-12-6-4-10-27(29)31;/h3-6,9-12,14-21H,2,7-8,13H2,1H3,(H,35,36);1H