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

Systemtic Name: N-(3-ethylphenyl)piperazin-4-ium-1-sulfonamide Openeye Name: N-(3-ethylphenyl)piperazin-4-ium-1-sulfonamide CAS Name: N-(3-ethylphenyl)-1-piperazin-4-iumsulfonamide IUPAC Name: N-(3-ethylphenyl)piperazin-4-ium-1-sulfonamide Traditional Name: N-(3-ethylphenyl)piperazin-4-ium-1-sulfonamide Formula: C12H20N3O2S+ MolecularWeight: 270.3711

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NS(=O)(=O)N2CC[NH2+]CC2

Isomeric SMILES

CCC1=CC(=CC=C1)NS(=O)(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C12H19N3O2S/c1-2-11-4-3-5-12(10-11)14-18(16,17)15-8-6-13-7-9-15/h3-5,10,13-14H,2,6-9H2,1H3/p+1