(phenylmethyl) 5-(3-chlorophenyl)-2-ethanoyl-pentanoate

Systemtic Name: (phenylmethyl) 5-(3-chlorophenyl)-2-ethanoyl-pentanoate Openeye Name: benzyl 2-acetyl-5-(3-chlorophenyl)pentanoate CAS Name: 2-acetyl-5-(3-chlorophenyl)pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-acetyl-5-(3-chlorophenyl)pentanoate Traditional Name: 2-acetyl-5-(3-chlorophenyl)valeric acid benzyl ester Formula: C20H21ClO3 MolecularWeight: 344.83194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCCC1=CC(=CC=C1)Cl)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)C(CCCC1=CC(=CC=C1)Cl)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H21ClO3/c1-15(22)19(12-6-10-16-9-5-11-18(21)13-16)20(23)24-14-17-7-3-2-4-8-17/h2-5,7-9,11,13,19H,6,10,12,14H2,1H3