3-piperidin-1-ium-1-ylpropyl-[(3S)-thiolan-3-yl]azanium

Systemtic Name: 3-piperidin-1-ium-1-ylpropyl-[(3S)-thiolan-3-yl]azanium Openeye Name: 3-piperidin-1-ium-1-ylpropyl-[(3S)-tetrahydrothiophen-3-yl]ammonium CAS Name: 3-(1-piperidin-1-iumyl)propyl-[(3S)-3-thiolanyl]ammonium IUPAC Name: 3-piperidin-1-ium-1-ylpropyl-[(3S)-thiolan-3-yl]azanium Traditional Name: 3-piperidin-1-ium-1-ylpropyl-[(3S)-tetrahydrothiophen-3-yl]ammonium Formula: C12H26N2S+2 MolecularWeight: 230.41324

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCC[NH2+]C2CCSC2

Isomeric SMILES

C1CC[NH+](CC1)CCC[NH2+][C@H]2CCSC2

InChI

InChI=1S/C12H24N2S/c1-2-7-14(8-3-1)9-4-6-13-12-5-10-15-11-12/h12-13H,1-11H2/p+2/t12-/m0/s1