2,5-bis(chloranyl)-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzenesulfonamide

Systemtic Name: 2,5-bis(chloranyl)-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzenesulfonamide Openeye Name: 2,5-dichloro-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzenesulfonamide CAS Name: 2,5-dichloro-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzenesulfonamide IUPAC Name: 2,5-dichloro-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzenesulfonamide Traditional Name: 2,5-dichloro-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzenesulfonamide Formula: C13H16Cl2N3O2S+ MolecularWeight: 349.25604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=N[N+](=C(C1CNS(=O)(=O)C2=C(C=CC(=C2)Cl)Cl)C)C

Isomeric SMILES

CC1=N[N+](=C(C1CNS(=O)(=O)C2=C(C=CC(=C2)Cl)Cl)C)C

InChI

InChI=1S/C13H16Cl2N3O2S/c1-8-11(9(2)18(3)17-8)7-16-21(19,20)13-6-10(14)4-5-12(13)15/h4-6,11,16H,7H2,1-3H3/q+1