(2-tert-butylphenyl) 4-(4-methylphenoxy)butanoate

Systemtic Name: (2-tert-butylphenyl) 4-(4-methylphenoxy)butanoate Openeye Name: (2-tert-butylphenyl) 4-(4-methylphenoxy)butanoate CAS Name: 4-(4-methylphenoxy)butanoic acid (2-tert-butylphenyl) ester IUPAC Name: (2-tert-butylphenyl) 4-(4-methylphenoxy)butanoate Traditional Name: 4-(4-methylphenoxy)butyric acid (2-tert-butylphenyl) ester Formula: C21H26O3 MolecularWeight: 326.42934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCCC(=O)OC2=CC=CC=C2C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)OCCCC(=O)OC2=CC=CC=C2C(C)(C)C

InChI

InChI=1S/C21H26O3/c1-16-11-13-17(14-12-16)23-15-7-10-20(22)24-19-9-6-5-8-18(19)21(2,3)4/h5-6,8-9,11-14H,7,10,15H2,1-4H3