sodium 2-(2,2-dimethylpropyl)-4-methyl-6-(5-oxidanidylperoxysulfanylbenzotriazol-2-yl)phenol

Systemtic Name: sodium 2-(2,2-dimethylpropyl)-4-methyl-6-(5-oxidanidylperoxysulfanylbenzotriazol-2-yl)phenol Openeye Name: sodium 2-(2,2-dimethylpropyl)-4-methyl-6-(5-oxidoperoxysulfanylbenzotriazol-2-yl)phenol CAS Name: sodium 2-[3-(2,2-dimethylpropyl)-2-hydroxy-5-methylphenyl]-5-benzotriazolesulfenic acid oxidooxy ester IUPAC Name: sodium 2-(2,2-dimethylpropyl)-4-methyl-6-(5-oxidoperoxysulfanylbenzotriazol-2-yl)phenol Traditional Name: sodium 4-methyl-2-neopentyl-6-[5-(oxidoperoxythio)benzotriazol-2-yl]phenol Formula: C18H20N3NaO4S MolecularWeight: 397.42387

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)N2N=C3C=CC(=CC3=N2)SOO[O-])O)CC(C)(C)C.[Na+]

Isomeric SMILES

CC1=CC(=C(C(=C1)N2N=C3C=CC(=CC3=N2)SOO[O-])O)CC(C)(C)C.[Na+]

InChI

InChI=1S/C18H21N3O4S.Na/c1-11-7-12(10-18(2,3)4)17(22)16(8-11)21-19-14-6-5-13(26-25-24-23)9-15(14)20-21;/h5-9,22-23H,10H2,1-4H3;/q;+1/p-1