furan-2-ylmethyl-methyl-[[(3S)-piperidin-1-ium-3-yl]methyl]azanium

Systemtic Name: furan-2-ylmethyl-methyl-[[(3S)-piperidin-1-ium-3-yl]methyl]azanium Openeye Name: 2-furylmethyl-methyl-[[(3S)-piperidin-1-ium-3-yl]methyl]ammonium CAS Name: 2-furanylmethyl-methyl-[[(3S)-3-piperidin-1-iumyl]methyl]ammonium IUPAC Name: furan-2-ylmethyl-methyl-[[(3S)-piperidin-1-ium-3-yl]methyl]azanium Traditional Name: 2-furfuryl-methyl-[[(3S)-piperidin-1-ium-3-yl]methyl]ammonium Formula: C12H22N2O+2 MolecularWeight: 210.31588

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1CCC[NH2+]C1)CC2=CC=CO2

Isomeric SMILES

C[NH+](C[C@H]1CCC[NH2+]C1)CC2=CC=CO2

InChI

InChI=1S/C12H20N2O/c1-14(10-12-5-3-7-15-12)9-11-4-2-6-13-8-11/h3,5,7,11,13H,2,4,6,8-10H2,1H3/p+2/t11-/m0/s1