sodium 6-(4-methoxyphenyl)-2-oxidanylidene-hexanoate

Systemtic Name: sodium 6-(4-methoxyphenyl)-2-oxidanylidene-hexanoate Openeye Name: sodium 6-(4-methoxyphenyl)-2-oxo-hexanoate CAS Name: sodium 6-(4-methoxyphenyl)-2-oxohexanoate IUPAC Name: sodium 6-(4-methoxyphenyl)-2-oxohexanoate Traditional Name: sodium 2-keto-6-(4-methoxyphenyl)hexanoate Formula: C13H15NaO4 MolecularWeight: 258.24557

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCCCC(=O)C(=O)[O-].[Na+]

Isomeric SMILES

COC1=CC=C(C=C1)CCCCC(=O)C(=O)[O-].[Na+]

InChI

InChI=1S/C13H16O4.Na/c1-17-11-8-6-10(7-9-11)4-2-3-5-12(14)13(15)16;/h6-9H,2-5H2,1H3,(H,15,16);/q;+1/p-1