sodium 2-oxidanylidene-3-phenyl-nonanoate

Systemtic Name: sodium 2-oxidanylidene-3-phenyl-nonanoate Openeye Name: sodium 2-oxo-3-phenyl-nonanoate CAS Name: sodium 2-oxo-3-phenylnonanoate IUPAC Name: sodium 2-oxo-3-phenylnonanoate Traditional Name: sodium 2-keto-3-phenyl-pelargonate Formula: C15H19NaO3 MolecularWeight: 270.29933

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20O3.Na/c1-2-3-4-8-11-13(14(16)15(17)18)12-9-6-5-7-10-12;/h5-7,9-10,13H,2-4,8,11H2,1H3,(H,17,18);/q;+1/p-1