3-[1-(1-benzothiophen-2-ylmethyl)piperidin-1-ium-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide

Systemtic Name: 3-[1-(1-benzothiophen-2-ylmethyl)piperidin-1-ium-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide Openeye Name: 3-[1-(benzothiophen-2-ylmethyl)piperidin-1-ium-4-yl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]propanamide CAS Name: 3-[1-(1-benzothiophen-2-ylmethyl)-4-piperidin-1-iumyl]-N-[[(2R)-2-oxolanyl]methyl]propanamide IUPAC Name: 3-[1-(1-benzothiophen-2-ylmethyl)piperidin-1-ium-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide Traditional Name: 3-[1-(benzothiophen-2-ylmethyl)piperidin-1-ium-4-yl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]propionamide Formula: C22H31N2O2S+ MolecularWeight: 387.55874

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)CCC2CC[NH+](CC2)CC3=CC4=CC=CC=C4S3

Isomeric SMILES

C1C[C@@H](OC1)CNC(=O)CCC2CC[NH+](CC2)CC3=CC4=CC=CC=C4S3

InChI

InChI=1S/C22H30N2O2S/c25-22(23-15-19-5-3-13-26-19)8-7-17-9-11-24(12-10-17)16-20-14-18-4-1-2-6-21(18)27-20/h1-2,4,6,14,17,19H,3,5,7-13,15-16H2,(H,23,25)/p+1/t19-/m1/s1