2-[(5-azanylperoxypyridin-2-yl)diazenyl]-5-[propyl(3-sulfopropyl)amino]phenolate

Systemtic Name: 2-[(5-azanylperoxypyridin-2-yl)diazenyl]-5-[propyl(3-sulfopropyl)amino]phenolate Openeye Name: 2-[(5-aminoperoxy-2-pyridyl)azo]-5-[propyl(3-sulfopropyl)amino]phenolate CAS Name: 2-[(5-aminodioxy-2-pyridinyl)azo]-5-[propyl(3-sulfopropyl)amino]phenolate IUPAC Name: 2-[(5-aminoperoxypyridin-2-yl)diazenyl]-5-[propyl(3-sulfopropyl)amino]phenolate Traditional Name: 2-[(5-aminoperoxy-2-pyridyl)azo]-5-[propyl(3-sulfopropyl)amino]phenolate Formula: C17H22N5O6S- MolecularWeight: 424.45148

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCS(=O)(=O)O)C1=CC(=C(C=C1)N=NC2=NC=C(C=C2)OON)[O-]

Isomeric SMILES

CCCN(CCCS(=O)(=O)O)C1=CC(=C(C=C1)N=NC2=NC=C(C=C2)OON)[O-]

InChI

InChI=1S/C17H23N5O6S/c1-2-8-22(9-3-10-29(24,25)26)13-4-6-15(16(23)11-13)20-21-17-7-5-14(12-19-17)27-28-18/h4-7,11-12,23H,2-3,8-10,18H2,1H3,(H,24,25,26)/p-1