sodium 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxidanyl-butanoate

Systemtic Name: sodium 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxidanyl-butanoate Openeye Name: sodium 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-hydroxy-butanoate CAS Name: sodium 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-hydroxybutanoate IUPAC Name: sodium 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-hydroxybutanoate Traditional Name: sodium 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-hydroxy-butyrate Formula: C12H13NaO5 MolecularWeight: 260.21839

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(CCC(=O)[O-])O.[Na+]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(CCC(=O)[O-])O.[Na+]

InChI

InChI=1S/C12H14O5.Na/c13-9(2-4-12(14)15)8-1-3-10-11(7-8)17-6-5-16-10;/h1,3,7,9,13H,2,4-6H2,(H,14,15);/q;+1/p-1