4-ethanoyl-5-oxidanylidene-3-phenyl-hexanal

Systemtic Name: 4-ethanoyl-5-oxidanylidene-3-phenyl-hexanal Openeye Name: 4-acetyl-5-oxo-3-phenyl-hexanal CAS Name: 4-acetyl-5-oxo-3-phenylhexanal IUPAC Name: 4-acetyl-5-oxo-3-phenylhexanal Traditional Name: 4-acetyl-5-keto-3-phenyl-hexanal Formula: C14H16O3 MolecularWeight: 232.27504

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(CC=O)C1=CC=CC=C1)C(=O)C

Isomeric SMILES

CC(=O)C(C(CC=O)C1=CC=CC=C1)C(=O)C

InChI

InChI=1S/C14H16O3/c1-10(16)14(11(2)17)13(8-9-15)12-6-4-3-5-7-12/h3-7,9,13-14H,8H2,1-2H3