hexyl 2-oxidanylidene-4-phenyl-butanoate

Systemtic Name: hexyl 2-oxidanylidene-4-phenyl-butanoate Openeye Name: hexyl 2-oxo-4-phenyl-butanoate CAS Name: 2-oxo-4-phenylbutanoic acid hexyl ester IUPAC Name: hexyl 2-oxo-4-phenylbutanoate Traditional Name: 2-keto-4-phenyl-butyric acid hexyl ester Formula: C16H22O3 MolecularWeight: 262.34408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(=O)CCC1=CC=CC=C1

Isomeric SMILES

CCCCCCOC(=O)C(=O)CCC1=CC=CC=C1

InChI

InChI=1S/C16H22O3/c1-2-3-4-8-13-19-16(18)15(17)12-11-14-9-6-5-7-10-14/h5-7,9-10H,2-4,8,11-13H2,1H3