methyl 4-(5-methyl-4-oxidanyl-hexyl)benzoate

Systemtic Name: methyl 4-(5-methyl-4-oxidanyl-hexyl)benzoate Openeye Name: methyl 4-(4-hydroxy-5-methyl-hexyl)benzoate CAS Name: 4-(4-hydroxy-5-methylhexyl)benzoic acid methyl ester IUPAC Name: methyl 4-(4-hydroxy-5-methylhexyl)benzoate Traditional Name: 4-(4-hydroxy-5-methyl-hexyl)benzoic acid methyl ester Formula: C15H22O3 MolecularWeight: 250.33338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCC1=CC=C(C=C1)C(=O)OC)O

Isomeric SMILES

CC(C)C(CCCC1=CC=C(C=C1)C(=O)OC)O

InChI

InChI=1S/C15H22O3/c1-11(2)14(16)6-4-5-12-7-9-13(10-8-12)15(17)18-3/h7-11,14,16H,4-6H2,1-3H3