(4-tert-butylphenyl) 3-[3-(4-methylphenyl)phenyl]prop-2-ynoate

Systemtic Name: (4-tert-butylphenyl) 3-[3-(4-methylphenyl)phenyl]prop-2-ynoate Openeye Name: (4-tert-butylphenyl) 3-[3-(p-tolyl)phenyl]prop-2-ynoate CAS Name: 3-[3-(4-methylphenyl)phenyl]-2-propynoic acid (4-tert-butylphenyl) ester IUPAC Name: (4-tert-butylphenyl) 3-[3-(4-methylphenyl)phenyl]prop-2-ynoate Traditional Name: 3-[3-(p-tolyl)phenyl]propiolic acid (4-tert-butylphenyl) ester Formula: C26H24O2 MolecularWeight: 368.46756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=CC(=C2)C#CC(=O)OC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=CC(=C2)C#CC(=O)OC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C26H24O2/c1-19-8-11-21(12-9-19)22-7-5-6-20(18-22)10-17-25(27)28-24-15-13-23(14-16-24)26(2,3)4/h5-9,11-16,18H,1-4H3