sodium (2R)-2-[(4S)-2-deuterio-2-(4-methoxycarbonylphenyl)-1,3-dioxolan-4-yl]-4-oxidanyl-5-oxidanylidene-2H-furan-3-olate

Systemtic Name: sodium (2R)-2-[(4S)-2-deuterio-2-(4-methoxycarbonylphenyl)-1,3-dioxolan-4-yl]-4-oxidanyl-5-oxidanylidene-2H-furan-3-olate Openeye Name: sodium (2R)-2-[(4S)-2-deuterio-2-(4-methoxycarbonylphenyl)-1,3-dioxolan-4-yl]-4-hydroxy-5-oxo-2H-furan-3-olate CAS Name: sodium (2R)-2-[(4S)-2-deuterio-2-(4-methoxycarbonylphenyl)-1,3-dioxolan-4-yl]-4-hydroxy-5-oxo-2H-furan-3-olate IUPAC Name: sodium (2R)-2-[(4S)-2-deuterio-2-(4-methoxycarbonylphenyl)-1,3-dioxolan-4-yl]-4-hydroxy-5-oxo-2H-furan-3-olate Traditional Name: sodium (2R)-2-[(4S)-2-(4-carbomethoxyphenyl)-2-deuterio-1,3-dioxolan-4-yl]-4-hydroxy-5-keto-2H-furan-3-olate Formula: C15H13NaO8 MolecularWeight: 345.254852

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2OCC(O2)C3C(=C(C(=O)O3)O)[O-].[Na+]

Isomeric SMILES

[2H]C1(OC[C@H](O1)[C@@H]2C(=C(C(=O)O2)O)[O-])C3=CC=C(C=C3)C(=O)OC.[Na+]

InChI

InChI=1S/C15H14O8.Na/c1-20-13(18)7-2-4-8(5-3-7)15-21-6-9(22-15)12-10(16)11(17)14(19)23-12;/h2-5,9,12,15-17H,6H2,1H3;/q;+1/p-1/t9-,12+,15?;/m0./s1/i15D;