N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]-4-propyl-benzenesulfonamide

Systemtic Name: N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]-4-propyl-benzenesulfonamide Openeye Name: N-[(1-isopropylpiperidin-1-ium-4-yl)methyl]-4-propyl-benzenesulfonamide CAS Name: N-[(1-propan-2-yl-4-piperidin-1-iumyl)methyl]-4-propylbenzenesulfonamide IUPAC Name: N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]-4-propylbenzenesulfonamide Traditional Name: N-[(1-isopropylpiperidin-1-ium-4-yl)methyl]-4-propyl-benzenesulfonamide Formula: C18H31N2O2S+ MolecularWeight: 339.51594

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)NCC2CC[NH+](CC2)C(C)C

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)NCC2CC[NH+](CC2)C(C)C

InChI

InChI=1S/C18H30N2O2S/c1-4-5-16-6-8-18(9-7-16)23(21,22)19-14-17-10-12-20(13-11-17)15(2)3/h6-9,15,17,19H,4-5,10-14H2,1-3H3/p+1