(2R)-4-(furan-2-ylmethylamino)-4-oxidanylidene-2-(3-oxidanylpropylazaniumyl)butanoate

Systemtic Name: (2R)-4-(furan-2-ylmethylamino)-4-oxidanylidene-2-(3-oxidanylpropylazaniumyl)butanoate Openeye Name: (2R)-4-(2-furylmethylamino)-2-(3-hydroxypropylammonio)-4-oxo-butanoate CAS Name: (2R)-4-(2-furanylmethylamino)-2-(3-hydroxypropylammonio)-4-oxobutanoate IUPAC Name: (2R)-4-(furan-2-ylmethylamino)-2-(3-hydroxypropylazaniumyl)-4-oxobutanoate Traditional Name: (2R)-4-(2-furfurylamino)-2-(3-hydroxypropylammonio)-4-keto-butyrate Formula: C12H18N2O5 MolecularWeight: 270.28172

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(=O)CC(C(=O)[O-])[NH2+]CCCO

Isomeric SMILES

C1=COC(=C1)CNC(=O)C[C@H](C(=O)[O-])[NH2+]CCCO

InChI

InChI=1S/C12H18N2O5/c15-5-2-4-13-10(12(17)18)7-11(16)14-8-9-3-1-6-19-9/h1,3,6,10,13,15H,2,4-5,7-8H2,(H,14,16)(H,17,18)/t10-/m1/s1