3-cyclohexylsulfonyl-6-(2-methoxyphenyl)sulfonyl-1-oxidanidyl-pyridazin-1-ium

Systemtic Name: 3-cyclohexylsulfonyl-6-(2-methoxyphenyl)sulfonyl-1-oxidanidyl-pyridazin-1-ium Openeye Name: 3-cyclohexylsulfonyl-6-(2-methoxyphenyl)sulfonyl-1-oxido-pyridazin-1-ium CAS Name: 3-cyclohexylsulfonyl-6-(2-methoxyphenyl)sulfonyl-1-oxidopyridazin-1-ium IUPAC Name: 3-cyclohexylsulfonyl-6-(2-methoxyphenyl)sulfonyl-1-oxidopyridazin-1-ium Traditional Name: 3-cyclohexylsulfonyl-6-(2-methoxyphenyl)sulfonyl-1-oxido-pyridazin-1-ium Formula: C17H20N2O6S2 MolecularWeight: 412.4805

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1S(=O)(=O)C2=[N+](N=C(C=C2)S(=O)(=O)C3CCCCC3)[O-]

Isomeric SMILES

COC1=CC=CC=C1S(=O)(=O)C2=[N+](N=C(C=C2)S(=O)(=O)C3CCCCC3)[O-]

InChI

InChI=1S/C17H20N2O6S2/c1-25-14-9-5-6-10-15(14)27(23,24)17-12-11-16(18-19(17)20)26(21,22)13-7-3-2-4-8-13/h5-6,9-13H,2-4,7-8H2,1H3