4-[4-(2-hydroxyethyl)piperazin-1-yl]-N-propan-2-yl-pyridin-1-ium-3-sulfonamide

Systemtic Name: 4-[4-(2-hydroxyethyl)piperazin-1-yl]-N-propan-2-yl-pyridin-1-ium-3-sulfonamide Openeye Name: 4-[4-(2-hydroxyethyl)piperazin-1-yl]-N-isopropyl-pyridin-1-ium-3-sulfonamide CAS Name: 4-[4-(2-hydroxyethyl)-1-piperazinyl]-N-propan-2-yl-3-pyridin-1-iumsulfonamide IUPAC Name: 4-[4-(2-hydroxyethyl)piperazin-1-yl]-N-propan-2-ylpyridin-1-ium-3-sulfonamide Traditional Name: 4-[4-(2-hydroxyethyl)piperazino]-N-isopropyl-pyridin-1-ium-3-sulfonamide Formula: C14H25N4O3S+ MolecularWeight: 329.4383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=C(C=C[NH+]=C1)N2CCN(CC2)CCO

Isomeric SMILES

CC(C)NS(=O)(=O)C1=C(C=C[NH+]=C1)N2CCN(CC2)CCO

InChI

InChI=1S/C14H24N4O3S/c1-12(2)16-22(20,21)14-11-15-4-3-13(14)18-7-5-17(6-8-18)9-10-19/h3-4,11-12,16,19H,5-10H2,1-2H3/p+1