(3S)-3-(furan-2-ylmethylazaniumyl)-4-methoxy-4-oxidanylidene-butanoate

Systemtic Name: (3S)-3-(furan-2-ylmethylazaniumyl)-4-methoxy-4-oxidanylidene-butanoate Openeye Name: (3S)-3-(2-furylmethylammonio)-4-methoxy-4-oxo-butanoate CAS Name: (3S)-3-(2-furanylmethylammonio)-4-methoxy-4-oxobutanoate IUPAC Name: (3S)-3-(furan-2-ylmethylazaniumyl)-4-methoxy-4-oxobutanoate Traditional Name: (3S)-3-(2-furfurylammonio)-4-keto-4-methoxy-butyrate Formula: C10H13NO5 MolecularWeight: 227.21392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13NO5/c1-15-10(14)8(5-9(12)13)11-6-7-3-2-4-16-7/h2-4,8,11H,5-6H2,1H3,(H,12,13)/t8-/m0/s1