4-(6-cyclohexylsulfonyl-1-oxidanidyl-pyridazin-1-ium-3-yl)sulfonylphenol

Systemtic Name: 4-(6-cyclohexylsulfonyl-1-oxidanidyl-pyridazin-1-ium-3-yl)sulfonylphenol Openeye Name: 4-(6-cyclohexylsulfonyl-1-oxido-pyridazin-1-ium-3-yl)sulfonylphenol CAS Name: 4-[(6-cyclohexylsulfonyl-1-oxido-3-pyridazin-1-iumyl)sulfonyl]phenol IUPAC Name: 4-(6-cyclohexylsulfonyl-1-oxidopyridazin-1-ium-3-yl)sulfonylphenol Traditional Name: 4-(6-cyclohexylsulfonyl-1-oxido-pyridazin-1-ium-3-yl)sulfonylphenol Formula: C16H18N2O6S2 MolecularWeight: 398.45392

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)S(=O)(=O)C2=[N+](N=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)O)[O-]

Isomeric SMILES

C1CCC(CC1)S(=O)(=O)C2=[N+](N=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)O)[O-]

InChI

InChI=1S/C16H18N2O6S2/c19-12-6-8-14(9-7-12)25(21,22)15-10-11-16(18(20)17-15)26(23,24)13-4-2-1-3-5-13/h6-11,13,19H,1-5H2