(2R,3S)-1-(furan-2-ylmethyl)-2,3-dimethyl-piperidin-1-ium-4-one

Systemtic Name: (2R,3S)-1-(furan-2-ylmethyl)-2,3-dimethyl-piperidin-1-ium-4-one Openeye Name: (2R,3S)-1-(2-furylmethyl)-2,3-dimethyl-piperidin-1-ium-4-one CAS Name: (2R,3S)-1-(2-furanylmethyl)-2,3-dimethyl-4-piperidin-1-iumone IUPAC Name: (2R,3S)-1-(furan-2-ylmethyl)-2,3-dimethylpiperidin-1-ium-4-one Traditional Name: (2R,3S)-1-(2-furfuryl)-2,3-dimethyl-piperidin-1-ium-4-one Formula: C12H18NO2+ MolecularWeight: 208.27682

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Descriptors Computed from Structure

Canonical SMILES:

CC1C([NH+](CCC1=O)CC2=CC=CO2)C

Isomeric SMILES

C[C@H]1[C@H]([NH+](CCC1=O)CC2=CC=CO2)C

InChI

InChI=1S/C12H17NO2/c1-9-10(2)13(6-5-12(9)14)8-11-4-3-7-15-11/h3-4,7,9-10H,5-6,8H2,1-2H3/p+1/t9-,10+/m0/s1