2-[[5-methyl-4-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]furan-2-yl]carbonylamino]ethanoate

Systemtic Name: 2-[[5-methyl-4-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]furan-2-yl]carbonylamino]ethanoate Openeye Name: 2-[[5-methyl-4-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]furan-2-carbonyl]amino]acetate CAS Name: 2-[[[5-methyl-4-[[(2S)-2-methyl-1-piperidin-1-iumyl]methyl]-2-furanyl]-oxomethyl]amino]acetate IUPAC Name: 2-[[5-methyl-4-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]furan-2-carbonyl]amino]acetate Traditional Name: 2-[[5-methyl-4-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-2-furoyl]amino]acetate Formula: C15H22N2O4 MolecularWeight: 294.34618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC2=C(OC(=C2)C(=O)NCC(=O)[O-])C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC2=C(OC(=C2)C(=O)NCC(=O)[O-])C

InChI

InChI=1S/C15H22N2O4/c1-10-5-3-4-6-17(10)9-12-7-13(21-11(12)2)15(20)16-8-14(18)19/h7,10H,3-6,8-9H2,1-2H3,(H,16,20)(H,18,19)/t10-/m0/s1