[(2S)-1-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]propan-2-yl]azanium

Systemtic Name: [(2S)-1-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]propan-2-yl]azanium Openeye Name: [(1S)-2-[4-(2-furylmethyl)piperazin-4-ium-1-yl]-1-methyl-ethyl]ammonium CAS Name: [(2S)-1-[4-(2-furanylmethyl)-1-piperazin-4-iumyl]propan-2-yl]ammonium IUPAC Name: [(2S)-1-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]propan-2-yl]azanium Traditional Name: [(1S)-2-[4-(2-furfuryl)piperazin-4-ium-1-yl]-1-methyl-ethyl]ammonium Formula: C12H23N3O+2 MolecularWeight: 225.33052

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CC[NH+](CC1)CC2=CC=CO2)[NH3+]

Isomeric SMILES

C[C@@H](CN1CC[NH+](CC1)CC2=CC=CO2)[NH3+]

InChI

InChI=1S/C12H21N3O/c1-11(13)9-14-4-6-15(7-5-14)10-12-3-2-8-16-12/h2-3,8,11H,4-7,9-10,13H2,1H3/p+2/t11-/m0/s1