N-(2-propan-2-ylphenyl)piperazin-4-ium-1-sulfonamide

Systemtic Name: N-(2-propan-2-ylphenyl)piperazin-4-ium-1-sulfonamide Openeye Name: N-(2-isopropylphenyl)piperazin-4-ium-1-sulfonamide CAS Name: N-(2-propan-2-ylphenyl)-1-piperazin-4-iumsulfonamide IUPAC Name: N-(2-propan-2-ylphenyl)piperazin-4-ium-1-sulfonamide Traditional Name: N-o-cumenylpiperazin-4-ium-1-sulfonamide Formula: C13H22N3O2S+ MolecularWeight: 284.39768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NS(=O)(=O)N2CC[NH2+]CC2

Isomeric SMILES

CC(C)C1=CC=CC=C1NS(=O)(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C13H21N3O2S/c1-11(2)12-5-3-4-6-13(12)15-19(17,18)16-9-7-14-8-10-16/h3-6,11,14-15H,7-10H2,1-2H3/p+1