N-(3-methylphenyl)piperazin-4-ium-1-sulfonamide

Systemtic Name: N-(3-methylphenyl)piperazin-4-ium-1-sulfonamide Openeye Name: N-(m-tolyl)piperazin-4-ium-1-sulfonamide CAS Name: N-(3-methylphenyl)-1-piperazin-4-iumsulfonamide IUPAC Name: N-(3-methylphenyl)piperazin-4-ium-1-sulfonamide Traditional Name: N-(m-tolyl)piperazin-4-ium-1-sulfonamide Formula: C11H18N3O2S+ MolecularWeight: 256.34452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H17N3O2S/c1-10-3-2-4-11(9-10)13-17(15,16)14-7-5-12-6-8-14/h2-4,9,12-13H,5-8H2,1H3/p+1