N-phenyl-N-[1-[(2R)-1-thiophen-2-ylpropan-2-yl]piperidin-1-ium-4-yl]propanamide

Systemtic Name: N-phenyl-N-[1-[(2R)-1-thiophen-2-ylpropan-2-yl]piperidin-1-ium-4-yl]propanamide Openeye Name: N-[1-[(1R)-1-methyl-2-(2-thienyl)ethyl]piperidin-1-ium-4-yl]-N-phenyl-propanamide CAS Name: N-phenyl-N-[1-[(2R)-1-thiophen-2-ylpropan-2-yl]-4-piperidin-1-iumyl]propanamide IUPAC Name: N-phenyl-N-[1-[(2R)-1-thiophen-2-ylpropan-2-yl]piperidin-1-ium-4-yl]propanamide Traditional Name: N-[1-[(1R)-1-methyl-2-(2-thienyl)ethyl]piperidin-1-ium-4-yl]-N-phenyl-propionamide Formula: C21H29N2OS+ MolecularWeight: 357.53276

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1CC[NH+](CC1)C(C)CC2=CC=CS2)C3=CC=CC=C3

Isomeric SMILES

CCC(=O)N(C1CC[NH+](CC1)[C@H](C)CC2=CC=CS2)C3=CC=CC=C3

InChI

InChI=1S/C21H28N2OS/c1-3-21(24)23(18-8-5-4-6-9-18)19-11-13-22(14-12-19)17(2)16-20-10-7-15-25-20/h4-10,15,17,19H,3,11-14,16H2,1-2H3/p+1/t17-/m1/s1