3-iodanyl-N-[3-methyl-4-(trioxidanylsulfanyl)phenyl]propanamide

Systemtic Name: 3-iodanyl-N-[3-methyl-4-(trioxidanylsulfanyl)phenyl]propanamide Openeye Name: 3-iodo-N-[3-methyl-4-(trioxidanylsulfanyl)phenyl]propanamide CAS Name: 4-[(3-iodo-1-oxopropyl)amino]-2-methylbenzenesulfenic acid hydroperoxy ester IUPAC Name: 3-iodo-N-[3-methyl-4-(trioxidanylsulfanyl)phenyl]propanamide Traditional Name: 3-iodo-N-[3-methyl-4-(trioxidanylthio)phenyl]propionamide Formula: C10H12INO4S MolecularWeight: 369.17605

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CCI)SOOO

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CCI)SOOO

InChI

InChI=1S/C10H12INO4S/c1-7-6-8(12-10(13)4-5-11)2-3-9(7)17-16-15-14/h2-3,6,14H,4-5H2,1H3,(H,12,13)