2-[[5-methyl-4-(piperidin-1-ium-1-ylmethyl)furan-2-yl]carbonylamino]ethanoate

Systemtic Name: 2-[[5-methyl-4-(piperidin-1-ium-1-ylmethyl)furan-2-yl]carbonylamino]ethanoate Openeye Name: 2-[[5-methyl-4-(piperidin-1-ium-1-ylmethyl)furan-2-carbonyl]amino]acetate CAS Name: 2-[[[5-methyl-4-(1-piperidin-1-iumylmethyl)-2-furanyl]-oxomethyl]amino]acetate IUPAC Name: 2-[[5-methyl-4-(piperidin-1-ium-1-ylmethyl)furan-2-carbonyl]amino]acetate Traditional Name: 2-[[5-methyl-4-(piperidin-1-ium-1-ylmethyl)-2-furoyl]amino]acetate Formula: C14H20N2O4 MolecularWeight: 280.3196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(=O)NCC(=O)[O-])C[NH+]2CCCCC2

Isomeric SMILES

CC1=C(C=C(O1)C(=O)NCC(=O)[O-])C[NH+]2CCCCC2

InChI

InChI=1S/C14H20N2O4/c1-10-11(9-16-5-3-2-4-6-16)7-12(20-10)14(19)15-8-13(17)18/h7H,2-6,8-9H2,1H3,(H,15,19)(H,17,18)