dodecyl 2-(2,6-dimethoxyphenyl)carbonyl-4-methyl-pentanoate

Systemtic Name: dodecyl 2-(2,6-dimethoxyphenyl)carbonyl-4-methyl-pentanoate Openeye Name: dodecyl 2-(2,6-dimethoxybenzoyl)-4-methyl-pentanoate CAS Name: 2-[(2,6-dimethoxyphenyl)-oxomethyl]-4-methylpentanoic acid dodecyl ester IUPAC Name: dodecyl 2-(2,6-dimethoxybenzoyl)-4-methylpentanoate Traditional Name: 2-(2,6-dimethoxybenzoyl)-4-methyl-valeric acid lauryl ester Formula: C27H44O5 MolecularWeight: 448.63526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C(CC(C)C)C(=O)C1=C(C=CC=C1OC)OC

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C(CC(C)C)C(=O)C1=C(C=CC=C1OC)OC

InChI

InChI=1S/C27H44O5/c1-6-7-8-9-10-11-12-13-14-15-19-32-27(29)22(20-21(2)3)26(28)25-23(30-4)17-16-18-24(25)31-5/h16-18,21-22H,6-15,19-20H2,1-5H3