4-oxidanylidene-4-(4-pentylphenyl)butanoate

Systemtic Name: 4-oxidanylidene-4-(4-pentylphenyl)butanoate Openeye Name: 4-oxo-4-(4-pentylphenyl)butanoate CAS Name: 4-oxo-4-(4-pentylphenyl)butanoate IUPAC Name: 4-oxo-4-(4-pentylphenyl)butanoate Traditional Name: 4-(4-amylphenyl)-4-keto-butyrate Formula: C15H19O3- MolecularWeight: 247.30956

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)CCC(=O)[O-]

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C15H20O3/c1-2-3-4-5-12-6-8-13(9-7-12)14(16)10-11-15(17)18/h6-9H,2-5,10-11H2,1H3,(H,17,18)/p-1