methyl 6-[[3-[(2-bromanyl-5-methyl-phenyl)sulfamoyl]phenyl]carbonylamino]hexanoate

Systemtic Name: methyl 6-[[3-[(2-bromanyl-5-methyl-phenyl)sulfamoyl]phenyl]carbonylamino]hexanoate Openeye Name: methyl 6-[[3-[(2-bromo-5-methyl-phenyl)sulfamoyl]benzoyl]amino]hexanoate CAS Name: 6-[[[3-[(2-bromo-5-methylphenyl)sulfamoyl]phenyl]-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[3-[(2-bromo-5-methylphenyl)sulfamoyl]benzoyl]amino]hexanoate Traditional Name: 6-[[3-[(2-bromo-5-methyl-phenyl)sulfamoyl]benzoyl]amino]hexanoic acid methyl ester Formula: C21H25BrN2O5S MolecularWeight: 497.4026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Br)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NCCCCCC(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)Br)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NCCCCCC(=O)OC

InChI

InChI=1S/C21H25BrN2O5S/c1-15-10-11-18(22)19(13-15)24-30(27,28)17-8-6-7-16(14-17)21(26)23-12-5-3-4-9-20(25)29-2/h6-8,10-11,13-14,24H,3-5,9,12H2,1-2H3,(H,23,26)