methyl 7-methoxyperoxysulfanyl-5-[(3-methyl-2-oxidanyl-phenyl)carbonylamino]-4-oxidanyl-naphthalene-2-sulfonate

Systemtic Name: methyl 7-methoxyperoxysulfanyl-5-[(3-methyl-2-oxidanyl-phenyl)carbonylamino]-4-oxidanyl-naphthalene-2-sulfonate Openeye Name: methyl 4-hydroxy-5-[(2-hydroxy-3-methyl-benzoyl)amino]-7-methoxyperoxysulfanyl-naphthalene-2-sulfonate CAS Name: 4-hydroxy-5-[[(2-hydroxy-3-methylphenyl)-oxomethyl]amino]-7-(methoxydioxythio)-2-naphthalenesulfonic acid methyl ester IUPAC Name: methyl 4-hydroxy-5-[(2-hydroxy-3-methylbenzoyl)amino]-7-methoxyperoxysulfanylnaphthalene-2-sulfonate Traditional Name: 4-hydroxy-5-[(2-hydroxy-3-methyl-benzoyl)amino]-7-(methoxyperoxythio)naphthalene-2-sulfonic acid methyl ester Formula: C20H19NO9S2 MolecularWeight: 481.49616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1O)C(=O)NC2=C3C(=CC(=C2)SOOOC)C=C(C=C3O)S(=O)(=O)OC

Isomeric SMILES

CC1=CC=CC(=C1O)C(=O)NC2=C3C(=CC(=C2)SOOOC)C=C(C=C3O)S(=O)(=O)OC

InChI

InChI=1S/C20H19NO9S2/c1-11-5-4-6-15(19(11)23)20(24)21-16-9-13(31-30-29-27-2)7-12-8-14(32(25,26)28-3)10-17(22)18(12)16/h4-10,22-23H,1-3H3,(H,21,24)