N-(1-bromanylpropan-2-yl)-2-ethyl-4-(trioxidanylsulfanyl)benzamide

Systemtic Name: N-(1-bromanylpropan-2-yl)-2-ethyl-4-(trioxidanylsulfanyl)benzamide Openeye Name: N-(2-bromo-1-methyl-ethyl)-2-ethyl-4-(trioxidanylsulfanyl)benzamide CAS Name: 4-[(1-bromopropan-2-ylamino)-oxomethyl]-3-ethylbenzenesulfenic acid hydroperoxy ester IUPAC Name: N-(1-bromopropan-2-yl)-2-ethyl-4-(trioxidanylsulfanyl)benzamide Traditional Name: N-(2-bromo-1-methyl-ethyl)-2-ethyl-4-(trioxidanylthio)benzamide Formula: C12H16BrNO4S MolecularWeight: 350.22874

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)SOOO)C(=O)NC(C)CBr

Isomeric SMILES

CCC1=C(C=CC(=C1)SOOO)C(=O)NC(C)CBr

InChI

InChI=1S/C12H16BrNO4S/c1-3-9-6-10(19-18-17-16)4-5-11(9)12(15)14-8(2)7-13/h4-6,8,16H,3,7H2,1-2H3,(H,14,15)