4-tert-butyl-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzenesulfonamide Formula: C17H26N3O2S+ MolecularWeight: 336.47224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N3O2S/c1-12-16(13(2)20(6)19-12)11-18-23(21,22)15-9-7-14(8-10-15)17(3,4)5/h7-10,16,18H,11H2,1-6H3/q+1