methyl 3-(3,5-dibutyl-4-oxidanyl-phenyl)propanoate

Systemtic Name: methyl 3-(3,5-dibutyl-4-oxidanyl-phenyl)propanoate Openeye Name: methyl 3-(3,5-dibutyl-4-hydroxy-phenyl)propanoate CAS Name: 3-(3,5-dibutyl-4-hydroxyphenyl)propanoic acid methyl ester IUPAC Name: methyl 3-(3,5-dibutyl-4-hydroxyphenyl)propanoate Traditional Name: 3-(3,5-dibutyl-4-hydroxy-phenyl)propionic acid methyl ester Formula: C18H28O3 MolecularWeight: 292.41312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=CC(=C1O)CCCC)CCC(=O)OC

Isomeric SMILES

CCCCC1=CC(=CC(=C1O)CCCC)CCC(=O)OC

InChI

InChI=1S/C18H28O3/c1-4-6-8-15-12-14(10-11-17(19)21-3)13-16(18(15)20)9-7-5-2/h12-13,20H,4-11H2,1-3H3