5-methyl-3-[(8-methyl-7-oxidanyl-naphthalen-2-yl)sulfanylperoxyamino]naphthalene-1-sulfonic acid

Systemtic Name: 5-methyl-3-[(8-methyl-7-oxidanyl-naphthalen-2-yl)sulfanylperoxyamino]naphthalene-1-sulfonic acid Openeye Name: 3-[(7-hydroxy-8-methyl-2-naphthyl)sulfanylperoxyamino]-5-methyl-naphthalene-1-sulfonic acid CAS Name: 3-[[(7-hydroxy-8-methyl-2-naphthalenyl)thio]dioxyamino]-5-methyl-1-naphthalenesulfonic acid IUPAC Name: 3-[(7-hydroxy-8-methylnaphthalen-2-yl)sulfanylperoxyamino]-5-methylnaphthalene-1-sulfonic acid Traditional Name: 3-[[(7-hydroxy-8-methyl-2-naphthyl)thio]peroxyamino]-5-methyl-naphthalene-1-sulfonic acid Formula: C22H19NO6S2 MolecularWeight: 457.51936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C(C=C(C=C12)NOOSC3=CC4=C(C=C3)C=CC(=C4C)O)S(=O)(=O)O

Isomeric SMILES

CC1=CC=CC2=C(C=C(C=C12)NOOSC3=CC4=C(C=C3)C=CC(=C4C)O)S(=O)(=O)O

InChI

InChI=1S/C22H19NO6S2/c1-13-4-3-5-18-19(13)10-16(11-22(18)31(25,26)27)23-28-29-30-17-8-6-15-7-9-21(24)14(2)20(15)12-17/h3-12,23-24H,1-2H3,(H,25,26,27)