sodium 4-oxidanylidene-4-pent-1-yn-3-yloxy-butanoate

Systemtic Name: sodium 4-oxidanylidene-4-pent-1-yn-3-yloxy-butanoate Openeye Name: sodium 4-(1-ethylprop-2-ynoxy)-4-oxo-butanoate CAS Name: sodium 4-oxo-4-pent-1-yn-3-yloxybutanoate IUPAC Name: sodium 4-oxo-4-pent-1-yn-3-yloxybutanoate Traditional Name: sodium 4-(1-ethylprop-2-ynoxy)-4-keto-butyrate Formula: C9H11NaO4 MolecularWeight: 206.17101

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#C)OC(=O)CCC(=O)[O-].[Na+]

Isomeric SMILES

CCC(C#C)OC(=O)CCC(=O)[O-].[Na+]

InChI

InChI=1S/C9H12O4.Na/c1-3-7(4-2)13-9(12)6-5-8(10)11;/h1,7H,4-6H2,2H3,(H,10,11);/q;+1/p-1