2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(furan-2-ylmethyl)ethanamide

Systemtic Name: 2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(furan-2-ylmethyl)ethanamide Openeye Name: 2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(2-furylmethyl)acetamide CAS Name: 2-[(3S,5S)-3,5-dimethyl-1-piperidin-1-iumyl]-N-(2-furanylmethyl)acetamide IUPAC Name: 2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(furan-2-ylmethyl)acetamide Traditional Name: 2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(2-furfuryl)acetamide Formula: C14H23N2O2+ MolecularWeight: 251.34462

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CC(=O)NCC2=CC=CO2)C

Isomeric SMILES

C[C@H]1C[C@@H](C[NH+](C1)CC(=O)NCC2=CC=CO2)C

InChI

InChI=1S/C14H22N2O2/c1-11-6-12(2)9-16(8-11)10-14(17)15-7-13-4-3-5-18-13/h3-5,11-12H,6-10H2,1-2H3,(H,15,17)/p+1/t11-,12-/m0/s1