(3R)-3-(furan-2-ylmethylazaniumyl)-4-(2-methoxyethoxy)-4-oxidanylidene-butanoate

Systemtic Name: (3R)-3-(furan-2-ylmethylazaniumyl)-4-(2-methoxyethoxy)-4-oxidanylidene-butanoate Openeye Name: (3R)-3-(2-furylmethylammonio)-4-(2-methoxyethoxy)-4-oxo-butanoate CAS Name: (3R)-3-(2-furanylmethylammonio)-4-(2-methoxyethoxy)-4-oxobutanoate IUPAC Name: (3R)-3-(furan-2-ylmethylazaniumyl)-4-(2-methoxyethoxy)-4-oxobutanoate Traditional Name: (3R)-3-(2-furfurylammonio)-4-keto-4-(2-methoxyethoxy)butyrate Formula: C12H17NO6 MolecularWeight: 271.26648

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C(CC(=O)[O-])[NH2+]CC1=CC=CO1

Isomeric SMILES

COCCOC(=O)[C@@H](CC(=O)[O-])[NH2+]CC1=CC=CO1

InChI

InChI=1S/C12H17NO6/c1-17-5-6-19-12(16)10(7-11(14)15)13-8-9-3-2-4-18-9/h2-4,10,13H,5-8H2,1H3,(H,14,15)/t10-/m1/s1