N-(4-ethoxyphenyl)piperazin-4-ium-1-sulfonamide

Systemtic Name: N-(4-ethoxyphenyl)piperazin-4-ium-1-sulfonamide Openeye Name: N-(4-ethoxyphenyl)piperazin-4-ium-1-sulfonamide CAS Name: N-(4-ethoxyphenyl)-1-piperazin-4-iumsulfonamide IUPAC Name: N-(4-ethoxyphenyl)piperazin-4-ium-1-sulfonamide Traditional Name: N-p-phenetylpiperazin-4-ium-1-sulfonamide Formula: C12H20N3O3S+ MolecularWeight: 286.3705

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NS(=O)(=O)N2CC[NH2+]CC2

Isomeric SMILES

CCOC1=CC=C(C=C1)NS(=O)(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C12H19N3O3S/c1-2-18-12-5-3-11(4-6-12)14-19(16,17)15-9-7-13-8-10-15/h3-6,13-14H,2,7-10H2,1H3/p+1