N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-4-ethoxy-3-fluoranyl-benzenesulfonamide

Systemtic Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-4-ethoxy-3-fluoranyl-benzenesulfonamide Openeye Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-4-ethoxy-3-fluoro-benzenesulfonamide CAS Name: N-[(1-cyclopentyl-4-piperidin-1-iumyl)methyl]-4-ethoxy-3-fluorobenzenesulfonamide IUPAC Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-4-ethoxy-3-fluorobenzenesulfonamide Traditional Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-4-ethoxy-3-fluoro-benzenesulfonamide Formula: C19H30FN2O3S+ MolecularWeight: 385.516503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)NCC2CC[NH+](CC2)C3CCCC3)F

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)NCC2CC[NH+](CC2)C3CCCC3)F

InChI

InChI=1S/C19H29FN2O3S/c1-2-25-19-8-7-17(13-18(19)20)26(23,24)21-14-15-9-11-22(12-10-15)16-5-3-4-6-16/h7-8,13,15-16,21H,2-6,9-12,14H2,1H3/p+1