sodium 3-iodanyl-N-(3-methyl-4-oxidanidylperoxysulfanyl-phenyl)propanamide

Systemtic Name: sodium 3-iodanyl-N-(3-methyl-4-oxidanidylperoxysulfanyl-phenyl)propanamide Openeye Name: sodium 3-iodo-N-(3-methyl-4-oxidoperoxysulfanyl-phenyl)propanamide CAS Name: sodium 4-[(3-iodo-1-oxopropyl)amino]-2-methylbenzenesulfenic acid oxidooxy ester IUPAC Name: sodium 3-iodo-N-(3-methyl-4-oxidoperoxysulfanylphenyl)propanamide Traditional Name: sodium 3-iodo-N-[3-methyl-4-(oxidoperoxythio)phenyl]propionamide Formula: C10H11INNaO4S MolecularWeight: 391.15788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CCI)SOO[O-].[Na+]

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CCI)SOO[O-].[Na+]

InChI

InChI=1S/C10H12INO4S.Na/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);/q;+1/p-1