4-ethoxy-N-(3-piperidin-1-ium-1-ylpropyl)benzenesulfonamide

Systemtic Name: 4-ethoxy-N-(3-piperidin-1-ium-1-ylpropyl)benzenesulfonamide Openeye Name: 4-ethoxy-N-(3-piperidin-1-ium-1-ylpropyl)benzenesulfonamide CAS Name: 4-ethoxy-N-[3-(1-piperidin-1-iumyl)propyl]benzenesulfonamide IUPAC Name: 4-ethoxy-N-(3-piperidin-1-ium-1-ylpropyl)benzenesulfonamide Traditional Name: 4-ethoxy-N-(3-piperidin-1-ium-1-ylpropyl)benzenesulfonamide Formula: C16H27N2O3S+ MolecularWeight: 327.46218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC[NH+]2CCCCC2

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC[NH+]2CCCCC2

InChI

InChI=1S/C16H26N2O3S/c1-2-21-15-7-9-16(10-8-15)22(19,20)17-11-6-14-18-12-4-3-5-13-18/h7-10,17H,2-6,11-14H2,1H3/p+1