methyl 4-(6-methylheptan-2-yl)benzoate

Systemtic Name: methyl 4-(6-methylheptan-2-yl)benzoate Openeye Name: methyl 4-(1,5-dimethylhexyl)benzoate CAS Name: 4-(6-methylheptan-2-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(6-methylheptan-2-yl)benzoate Traditional Name: 4-(1,5-dimethylhexyl)benzoic acid methyl ester Formula: C16H24O2 MolecularWeight: 248.36056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24O2/c1-12(2)6-5-7-13(3)14-8-10-15(11-9-14)16(17)18-4/h8-13H,5-7H2,1-4H3