1-[(3R)-3-(piperazin-4-ium-1-ylmethyl)piperidin-1-yl]-2-thiophen-2-yl-ethanone

Systemtic Name: 1-[(3R)-3-(piperazin-4-ium-1-ylmethyl)piperidin-1-yl]-2-thiophen-2-yl-ethanone Openeye Name: 1-[(3R)-3-(piperazin-4-ium-1-ylmethyl)-1-piperidyl]-2-(2-thienyl)ethanone CAS Name: 1-[(3R)-3-(1-piperazin-4-iumylmethyl)-1-piperidinyl]-2-thiophen-2-ylethanone IUPAC Name: 1-[(3R)-3-(piperazin-4-ium-1-ylmethyl)piperidin-1-yl]-2-thiophen-2-ylethanone Traditional Name: 1-[(3R)-3-(piperazin-4-ium-1-ylmethyl)piperidino]-2-(2-thienyl)ethanone Formula: C16H26N3OS+ MolecularWeight: 308.46214

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CC2=CC=CS2)CN3CC[NH2+]CC3

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)CC2=CC=CS2)CN3CC[NH2+]CC3

InChI

InChI=1S/C16H25N3OS/c20-16(11-15-4-2-10-21-15)19-7-1-3-14(13-19)12-18-8-5-17-6-9-18/h2,4,10,14,17H,1,3,5-9,11-13H2/p+1/t14-/m1/s1