3-bromanyl-N-[4-(trioxidanylsulfanyl)phenyl]propanamide

Systemtic Name: 3-bromanyl-N-[4-(trioxidanylsulfanyl)phenyl]propanamide Openeye Name: 3-bromo-N-[4-(trioxidanylsulfanyl)phenyl]propanamide CAS Name: 4-[(3-bromo-1-oxopropyl)amino]benzenesulfenic acid hydroperoxy ester IUPAC Name: 3-bromo-N-[4-(trioxidanylsulfanyl)phenyl]propanamide Traditional Name: 3-bromo-N-[4-(trioxidanylthio)phenyl]propionamide Formula: C9H10BrNO4S MolecularWeight: 308.149

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CCBr)SOOO

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CCBr)SOOO

InChI

InChI=1S/C9H10BrNO4S/c10-6-5-9(12)11-7-1-3-8(4-2-7)16-15-14-13/h1-4,13H,5-6H2,(H,11,12)