(phenylmethyl) 2-ethanoyl-7-phenyl-heptanoate

Systemtic Name: (phenylmethyl) 2-ethanoyl-7-phenyl-heptanoate Openeye Name: benzyl 2-acetyl-7-phenyl-heptanoate CAS Name: 2-acetyl-7-phenylheptanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-acetyl-7-phenylheptanoate Traditional Name: 2-acetyl-7-phenyl-enanthic acid benzyl ester Formula: C22H26O3 MolecularWeight: 338.44004

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCCCCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)C(CCCCCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H26O3/c1-18(23)21(22(24)25-17-20-14-8-3-9-15-20)16-10-4-7-13-19-11-5-2-6-12-19/h2-3,5-6,8-9,11-12,14-15,21H,4,7,10,13,16-17H2,1H3