(1-oxidanylidene-1-phenyl-heptan-2-yl) ethanoate

Systemtic Name: (1-oxidanylidene-1-phenyl-heptan-2-yl) ethanoate Openeye Name: 1-benzoylhexyl acetate CAS Name: acetic acid (1-oxo-1-phenylheptan-2-yl) ester IUPAC Name: (1-oxo-1-phenylheptan-2-yl) acetate Traditional Name: acetic acid 1-benzoylhexyl ester Formula: C15H20O3 MolecularWeight: 248.3175

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=O)C1=CC=CC=C1)OC(=O)C

Isomeric SMILES

CCCCCC(C(=O)C1=CC=CC=C1)OC(=O)C

InChI

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