[3-methyl-5-(2-methylpentan-2-yl)-4-oxidanyl-phenyl] dodecanoate

Systemtic Name: [3-methyl-5-(2-methylpentan-2-yl)-4-oxidanyl-phenyl] dodecanoate Openeye Name: [3-(1,1-dimethylbutyl)-4-hydroxy-5-methyl-phenyl] dodecanoate CAS Name: dodecanoic acid [4-hydroxy-3-methyl-5-(2-methylpentan-2-yl)phenyl] ester IUPAC Name: [4-hydroxy-3-methyl-5-(2-methylpentan-2-yl)phenyl] dodecanoate Traditional Name: lauric acid [3-(1,1-dimethylbutyl)-4-hydroxy-5-methyl-phenyl] ester Formula: C25H42O3 MolecularWeight: 390.59918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC1=CC(=C(C(=C1)C)O)C(C)(C)CCC

Isomeric SMILES

CCCCCCCCCCCC(=O)OC1=CC(=C(C(=C1)C)O)C(C)(C)CCC

InChI

InChI=1S/C25H42O3/c1-6-8-9-10-11-12-13-14-15-16-23(26)28-21-18-20(3)24(27)22(19-21)25(4,5)17-7-2/h18-19,27H,6-17H2,1-5H3