6-(2-ethylphenyl)-2-oxidanylidene-hexanoate

Systemtic Name: 6-(2-ethylphenyl)-2-oxidanylidene-hexanoate Openeye Name: 6-(2-ethylphenyl)-2-oxo-hexanoate CAS Name: 6-(2-ethylphenyl)-2-oxohexanoate IUPAC Name: 6-(2-ethylphenyl)-2-oxohexanoate Traditional Name: 6-(2-ethylphenyl)-2-keto-hexanoate Formula: C14H17O3- MolecularWeight: 233.28298

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1CCCCC(=O)C(=O)[O-]

Isomeric SMILES

CCC1=CC=CC=C1CCCCC(=O)C(=O)[O-]

InChI

InChI=1S/C14H18O3/c1-2-11-7-3-4-8-12(11)9-5-6-10-13(15)14(16)17/h3-4,7-8H,2,5-6,9-10H2,1H3,(H,16,17)/p-1