5-chloranyl-N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-2-methyl-benzenesulfonamide

Systemtic Name: 5-chloranyl-N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-2-methyl-benzenesulfonamide Openeye Name: 5-chloro-N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-2-methyl-benzenesulfonamide CAS Name: 5-chloro-N-[(1-cyclopentyl-4-piperidin-1-iumyl)methyl]-2-methylbenzenesulfonamide IUPAC Name: 5-chloro-N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-2-methylbenzenesulfonamide Traditional Name: 5-chloro-N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-2-methyl-benzenesulfonamide Formula: C18H28ClN2O2S+ MolecularWeight: 371.94512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)S(=O)(=O)NCC2CC[NH+](CC2)C3CCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)S(=O)(=O)NCC2CC[NH+](CC2)C3CCCC3

InChI

InChI=1S/C18H27ClN2O2S/c1-14-6-7-16(19)12-18(14)24(22,23)20-13-15-8-10-21(11-9-15)17-4-2-3-5-17/h6-7,12,15,17,20H,2-5,8-11,13H2,1H3/p+1