butyl 5-(2,5-dimethylphenoxy)-2,2-dimethyl-pentanoate

Systemtic Name: butyl 5-(2,5-dimethylphenoxy)-2,2-dimethyl-pentanoate Openeye Name: butyl 5-(2,5-dimethylphenoxy)-2,2-dimethyl-pentanoate CAS Name: 5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid butyl ester IUPAC Name: butyl 5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoate Traditional Name: 5-(2,5-dimethylphenoxy)-2,2-dimethyl-valeric acid butyl ester Formula: C19H30O3 MolecularWeight: 306.4397

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C)(C)CCCOC1=C(C=CC(=C1)C)C

Isomeric SMILES

CCCCOC(=O)C(C)(C)CCCOC1=C(C=CC(=C1)C)C

InChI

InChI=1S/C19H30O3/c1-6-7-12-22-18(20)19(4,5)11-8-13-21-17-14-15(2)9-10-16(17)3/h9-10,14H,6-8,11-13H2,1-5H3