N-(2-methyl-6-propan-2-yl-phenyl)piperazin-4-ium-1-sulfonamide

Systemtic Name: N-(2-methyl-6-propan-2-yl-phenyl)piperazin-4-ium-1-sulfonamide Openeye Name: N-(2-isopropyl-6-methyl-phenyl)piperazin-4-ium-1-sulfonamide CAS Name: N-(2-methyl-6-propan-2-ylphenyl)-1-piperazin-4-iumsulfonamide IUPAC Name: N-(2-methyl-6-propan-2-ylphenyl)piperazin-4-ium-1-sulfonamide Traditional Name: N-(2-isopropyl-6-methyl-phenyl)piperazin-4-ium-1-sulfonamide Formula: C14H24N3O2S+ MolecularWeight: 298.42426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NS(=O)(=O)N2CC[NH2+]CC2

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NS(=O)(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C14H23N3O2S/c1-11(2)13-6-4-5-12(3)14(13)16-20(18,19)17-9-7-15-8-10-17/h4-6,11,15-16H,7-10H2,1-3H3/p+1