3-methylnonan-3-yl benzoate

Systemtic Name: 3-methylnonan-3-yl benzoate Openeye Name: (1-ethyl-1-methyl-heptyl) benzoate CAS Name: benzoic acid 3-methylnonan-3-yl ester IUPAC Name: 3-methylnonan-3-yl benzoate Traditional Name: benzoic acid (1-ethyl-1-methyl-heptyl) ester Formula: C17H26O2 MolecularWeight: 262.38714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26O2/c1-4-6-7-11-14-17(3,5-2)19-16(18)15-12-9-8-10-13-15/h8-10,12-13H,4-7,11,14H2,1-3H3