[1-[(3S)-3-oxidanyl-3-thiophen-2-yl-propyl]piperidin-1-ium-4-yl]azanium

Systemtic Name: [1-[(3S)-3-oxidanyl-3-thiophen-2-yl-propyl]piperidin-1-ium-4-yl]azanium Openeye Name: [1-[(3S)-3-hydroxy-3-(2-thienyl)propyl]piperidin-1-ium-4-yl]ammonium CAS Name: [1-[(3S)-3-hydroxy-3-thiophen-2-ylpropyl]-4-piperidin-1-iumyl]ammonium IUPAC Name: [1-[(3S)-3-hydroxy-3-thiophen-2-ylpropyl]piperidin-1-ium-4-yl]azanium Traditional Name: [1-[(3S)-3-hydroxy-3-(2-thienyl)propyl]piperidin-1-ium-4-yl]ammonium Formula: C12H22N2OS+2 MolecularWeight: 242.38088

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1[NH3+])CCC(C2=CC=CS2)O

Isomeric SMILES

C1C[NH+](CCC1[NH3+])CC[C@@H](C2=CC=CS2)O

InChI

InChI=1S/C12H20N2OS/c13-10-3-6-14(7-4-10)8-5-11(15)12-2-1-9-16-12/h1-2,9-11,15H,3-8,13H2/p+2/t11-/m0/s1