5-[(1S)-1-(4-aminocarbonylpiperidin-1-ium-1-yl)ethyl]furan-2-carboxylate

Systemtic Name: 5-[(1S)-1-(4-aminocarbonylpiperidin-1-ium-1-yl)ethyl]furan-2-carboxylate Openeye Name: 5-[(1S)-1-(4-carbamoylpiperidin-1-ium-1-yl)ethyl]furan-2-carboxylate CAS Name: 5-[(1S)-1-(4-carbamoyl-1-piperidin-1-iumyl)ethyl]-2-furancarboxylate IUPAC Name: 5-[(1S)-1-(4-carbamoylpiperidin-1-ium-1-yl)ethyl]furan-2-carboxylate Traditional Name: 5-[(1S)-1-(4-carbamoylpiperidin-1-ium-1-yl)ethyl]-2-furoate Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(O1)C(=O)[O-])[NH+]2CCC(CC2)C(=O)N

Isomeric SMILES

C[C@@H](C1=CC=C(O1)C(=O)[O-])[NH+]2CCC(CC2)C(=O)N

InChI

InChI=1S/C13H18N2O4/c1-8(10-2-3-11(19-10)13(17)18)15-6-4-9(5-7-15)12(14)16/h2-3,8-9H,4-7H2,1H3,(H2,14,16)(H,17,18)/t8-/m0/s1