hexyl 3-[4-(4-hexoxy-2-methyl-4-oxidanylidene-butan-2-yl)-2-methoxy-5-oxidanyl-phenyl]-3-methyl-butanoate

Systemtic Name: hexyl 3-[4-(4-hexoxy-2-methyl-4-oxidanylidene-butan-2-yl)-2-methoxy-5-oxidanyl-phenyl]-3-methyl-butanoate Openeye Name: hexyl 3-[4-(3-hexoxy-1,1-dimethyl-3-oxo-propyl)-5-hydroxy-2-methoxy-phenyl]-3-methyl-butanoate CAS Name: 3-[4-(4-hexoxy-2-methyl-4-oxobutan-2-yl)-5-hydroxy-2-methoxyphenyl]-3-methylbutanoic acid hexyl ester IUPAC Name: hexyl 3-[4-(4-hexoxy-2-methyl-4-oxobutan-2-yl)-5-hydroxy-2-methoxyphenyl]-3-methylbutanoate Traditional Name: 3-[4-(3-hexoxy-3-keto-1,1-dimethyl-propyl)-5-hydroxy-2-methoxy-phenyl]-3-methyl-butyric acid hexyl ester Formula: C29H48O6 MolecularWeight: 492.68782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CC(C)(C)C1=CC(=C(C=C1OC)C(C)(C)CC(=O)OCCCCCC)O

Isomeric SMILES

CCCCCCOC(=O)CC(C)(C)C1=CC(=C(C=C1OC)C(C)(C)CC(=O)OCCCCCC)O

InChI

InChI=1S/C29H48O6/c1-8-10-12-14-16-34-26(31)20-28(3,4)22-19-25(33-7)23(18-24(22)30)29(5,6)21-27(32)35-17-15-13-11-9-2/h18-19,30H,8-17,20-21H2,1-7H3