[(1R)-1,2-bis(4-methylphenyl)-2-oxidanylidene-ethyl] 3-(2,5-dimethylphenoxy)propanoate

Systemtic Name: [(1R)-1,2-bis(4-methylphenyl)-2-oxidanylidene-ethyl] 3-(2,5-dimethylphenoxy)propanoate Openeye Name: [(1R)-2-oxo-1,2-bis(p-tolyl)ethyl] 3-(2,5-dimethylphenoxy)propanoate CAS Name: 3-(2,5-dimethylphenoxy)propanoic acid [(1R)-1,2-bis(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [(1R)-1,2-bis(4-methylphenyl)-2-oxoethyl] 3-(2,5-dimethylphenoxy)propanoate Traditional Name: 3-(2,5-dimethylphenoxy)propionic acid [(1R)-2-keto-1,2-bis(p-tolyl)ethyl] ester Formula: C27H28O4 MolecularWeight: 416.50882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(=O)C2=CC=C(C=C2)C)OC(=O)CCOC3=C(C=CC(=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C(=O)C2=CC=C(C=C2)C)OC(=O)CCOC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C27H28O4/c1-18-6-11-22(12-7-18)26(29)27(23-13-8-19(2)9-14-23)31-25(28)15-16-30-24-17-20(3)5-10-21(24)4/h5-14,17,27H,15-16H2,1-4H3/t27-/m1/s1