N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-4-propoxy-benzenesulfonamide

Systemtic Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-4-propoxy-benzenesulfonamide Openeye Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-4-propoxy-benzenesulfonamide CAS Name: N-[(1-cyclopentyl-4-piperidin-1-iumyl)methyl]-4-propoxybenzenesulfonamide IUPAC Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-4-propoxybenzenesulfonamide Traditional Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-4-propoxy-benzenesulfonamide Formula: C20H33N2O3S+ MolecularWeight: 381.55262

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)S(=O)(=O)NCC2CC[NH+](CC2)C3CCCC3

Isomeric SMILES

CCCOC1=CC=C(C=C1)S(=O)(=O)NCC2CC[NH+](CC2)C3CCCC3

InChI

InChI=1S/C20H32N2O3S/c1-2-15-25-19-7-9-20(10-8-19)26(23,24)21-16-17-11-13-22(14-12-17)18-5-3-4-6-18/h7-10,17-18,21H,2-6,11-16H2,1H3/p+1