hexyl 3-(5-methoxy-2-oxidanyl-phenyl)-3-methyl-butanoate

Systemtic Name: hexyl 3-(5-methoxy-2-oxidanyl-phenyl)-3-methyl-butanoate Openeye Name: hexyl 3-(2-hydroxy-5-methoxy-phenyl)-3-methyl-butanoate CAS Name: 3-(2-hydroxy-5-methoxyphenyl)-3-methylbutanoic acid hexyl ester IUPAC Name: hexyl 3-(2-hydroxy-5-methoxyphenyl)-3-methylbutanoate Traditional Name: 3-(2-hydroxy-5-methoxy-phenyl)-3-methyl-butyric acid hexyl ester Formula: C18H28O4 MolecularWeight: 308.41252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28O4/c1-5-6-7-8-11-22-17(20)13-18(2,3)15-12-14(21-4)9-10-16(15)19/h9-10,12,19H,5-8,11,13H2,1-4H3