(4-bromophenyl)methyl 5-[(4-butylphenyl)sulfamoyl]-2-methyl-benzoate

Systemtic Name: (4-bromophenyl)methyl 5-[(4-butylphenyl)sulfamoyl]-2-methyl-benzoate Openeye Name: (4-bromophenyl)methyl 5-[(4-butylphenyl)sulfamoyl]-2-methyl-benzoate CAS Name: 5-[(4-butylphenyl)sulfamoyl]-2-methylbenzoic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 5-[(4-butylphenyl)sulfamoyl]-2-methylbenzoate Traditional Name: 5-[(4-butylphenyl)sulfamoyl]-2-methyl-benzoic acid (4-bromobenzyl) ester Formula: C25H26BrNO4S MolecularWeight: 516.44724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)OCC3=CC=C(C=C3)Br

Isomeric SMILES

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)OCC3=CC=C(C=C3)Br

InChI

InChI=1S/C25H26BrNO4S/c1-3-4-5-19-9-13-22(14-10-19)27-32(29,30)23-15-6-18(2)24(16-23)25(28)31-17-20-7-11-21(26)12-8-20/h6-16,27H,3-5,17H2,1-2H3