methyl 2-(4-tert-butylphenyl)-4-phenyl-butanoate

Systemtic Name: methyl 2-(4-tert-butylphenyl)-4-phenyl-butanoate Openeye Name: methyl 2-(4-tert-butylphenyl)-4-phenyl-butanoate CAS Name: 2-(4-tert-butylphenyl)-4-phenylbutanoic acid methyl ester IUPAC Name: methyl 2-(4-tert-butylphenyl)-4-phenylbutanoate Traditional Name: 2-(4-tert-butylphenyl)-4-phenyl-butyric acid methyl ester Formula: C21H26O2 MolecularWeight: 310.42994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(CCC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(CCC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C21H26O2/c1-21(2,3)18-13-11-17(12-14-18)19(20(22)23-4)15-10-16-8-6-5-7-9-16/h5-9,11-14,19H,10,15H2,1-4H3