2-[(4-ethoxycarbonyl-2,5-dimethyl-furan-3-yl)methylazaniumyl]ethanoate

Systemtic Name: 2-[(4-ethoxycarbonyl-2,5-dimethyl-furan-3-yl)methylazaniumyl]ethanoate Openeye Name: 2-[(4-ethoxycarbonyl-2,5-dimethyl-3-furyl)methylammonio]acetate CAS Name: 2-[(4-ethoxycarbonyl-2,5-dimethyl-3-furanyl)methylammonio]acetate IUPAC Name: 2-[(4-ethoxycarbonyl-2,5-dimethylfuran-3-yl)methylazaniumyl]acetate Traditional Name: 2-[(4-carbethoxy-2,5-dimethyl-3-furyl)methylammonio]acetate Formula: C12H17NO5 MolecularWeight: 255.26708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C[NH2+]CC(=O)[O-])C)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C[NH2+]CC(=O)[O-])C)C

InChI

InChI=1S/C12H17NO5/c1-4-17-12(16)11-8(3)18-7(2)9(11)5-13-6-10(14)15/h13H,4-6H2,1-3H3,(H,14,15)