[6-methyl-5-(phenylcarbonyloxy)-4-propyl-heptan-3-yl] benzoate

Systemtic Name: [6-methyl-5-(phenylcarbonyloxy)-4-propyl-heptan-3-yl] benzoate Openeye Name: (3-benzoyloxy-1-ethyl-4-methyl-2-propyl-pentyl) benzoate CAS Name: benzoic acid (5-benzoyloxy-6-methyl-4-propylheptan-3-yl) ester IUPAC Name: (5-benzoyloxy-6-methyl-4-propylheptan-3-yl) benzoate Traditional Name: benzoic acid (3-benzoyloxy-1-ethyl-4-methyl-2-propyl-pentyl) ester Formula: C25H32O4 MolecularWeight: 396.51918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC)OC(=O)C1=CC=CC=C1)C(C(C)C)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCC(C(CC)OC(=O)C1=CC=CC=C1)C(C(C)C)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C25H32O4/c1-5-13-21(22(6-2)28-24(26)19-14-9-7-10-15-19)23(18(3)4)29-25(27)20-16-11-8-12-17-20/h7-12,14-18,21-23H,5-6,13H2,1-4H3