methyl 6-[[2-bromanyl-5-(prop-2-enylsulfamoyl)phenyl]carbonylamino]hexanoate

Systemtic Name: methyl 6-[[2-bromanyl-5-(prop-2-enylsulfamoyl)phenyl]carbonylamino]hexanoate Openeye Name: methyl 6-[[5-(allylsulfamoyl)-2-bromo-benzoyl]amino]hexanoate CAS Name: 6-[[[2-bromo-5-(prop-2-enylsulfamoyl)phenyl]-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[2-bromo-5-(prop-2-enylsulfamoyl)benzoyl]amino]hexanoate Traditional Name: 6-[[5-(allylsulfamoyl)-2-bromo-benzoyl]amino]hexanoic acid methyl ester Formula: C17H23BrN2O5S MolecularWeight: 447.34392

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)NCC=C)Br

Isomeric SMILES

COC(=O)CCCCCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)NCC=C)Br

InChI

InChI=1S/C17H23BrN2O5S/c1-3-10-20-26(23,24)13-8-9-15(18)14(12-13)17(22)19-11-6-4-5-7-16(21)25-2/h3,8-9,12,20H,1,4-7,10-11H2,2H3,(H,19,22)