5-methyl-6-oxidanyl-N-[2-(trioxidanylsulfanyl)ethynyl]naphthalene-2-sulfonamide

Systemtic Name: 5-methyl-6-oxidanyl-N-[2-(trioxidanylsulfanyl)ethynyl]naphthalene-2-sulfonamide Openeye Name: 6-hydroxy-5-methyl-N-[2-(trioxidanylsulfanyl)ethynyl]naphthalene-2-sulfonamide CAS Name: 2-[(6-hydroxy-5-methyl-2-naphthalenyl)sulfonylamino]ethynesulfenic acid hydroperoxy ester IUPAC Name: 6-hydroxy-5-methyl-N-[2-(trioxidanylsulfanyl)ethynyl]naphthalene-2-sulfonamide Traditional Name: 6-hydroxy-5-methyl-N-[2-(trioxidanylthio)ethynyl]naphthalene-2-sulfonamide Formula: C13H11NO6S2 MolecularWeight: 341.35954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C=CC(=C2)S(=O)(=O)NC#CSOOO)O

Isomeric SMILES

CC1=C(C=CC2=C1C=CC(=C2)S(=O)(=O)NC#CSOOO)O

InChI

InChI=1S/C13H11NO6S2/c1-9-12-4-3-11(8-10(12)2-5-13(9)15)22(17,18)14-6-7-21-20-19-16/h2-5,8,14-16H,1H3