3-bromanyl-N-[5-methoxy-2-methyl-4-(trioxidanylsulfanyl)phenyl]propanamide

Systemtic Name: 3-bromanyl-N-[5-methoxy-2-methyl-4-(trioxidanylsulfanyl)phenyl]propanamide Openeye Name: 3-bromo-N-[5-methoxy-2-methyl-4-(trioxidanylsulfanyl)phenyl]propanamide CAS Name: 4-[(3-bromo-1-oxopropyl)amino]-2-methoxy-5-methylbenzenesulfenic acid hydroperoxy ester IUPAC Name: 3-bromo-N-[5-methoxy-2-methyl-4-(trioxidanylsulfanyl)phenyl]propanamide Traditional Name: 3-bromo-N-[5-methoxy-2-methyl-4-(trioxidanylthio)phenyl]propionamide Formula: C11H14BrNO5S MolecularWeight: 352.20156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)CCBr)OC)SOOO

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)CCBr)OC)SOOO

InChI

InChI=1S/C11H14BrNO5S/c1-7-5-10(19-18-17-15)9(16-2)6-8(7)13-11(14)3-4-12/h5-6,15H,3-4H2,1-2H3,(H,13,14)