(phenylmethyl) 5-methyl-2-propan-2-yl-hexanoate

Systemtic Name: (phenylmethyl) 5-methyl-2-propan-2-yl-hexanoate Openeye Name: benzyl 2-isopropyl-5-methyl-hexanoate CAS Name: 5-methyl-2-propan-2-ylhexanoic acid (phenylmethyl) ester IUPAC Name: benzyl 5-methyl-2-propan-2-ylhexanoate Traditional Name: 2-isopropyl-5-methyl-hexanoic acid benzyl ester Formula: C17H26O2 MolecularWeight: 262.38714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C(C)C)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)CCC(C(C)C)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H26O2/c1-13(2)10-11-16(14(3)4)17(18)19-12-15-8-6-5-7-9-15/h5-9,13-14,16H,10-12H2,1-4H3