O1-tert-butyl O3-[(E)-3-phenylprop-2-enoyl] 2-(4-phenylphenyl)propanedioate

Systemtic Name: O1-tert-butyl O3-[(E)-3-phenylprop-2-enoyl] 2-(4-phenylphenyl)propanedioate Openeye Name: O1-tert-butyl O3-[(E)-3-phenylprop-2-enoyl] 2-(4-phenylphenyl)propanedioate CAS Name: 2-(4-phenylphenyl)propanedioic acid O1-tert-butyl ester O3-[(E)-1-oxo-3-phenylprop-2-enyl] ester IUPAC Name: 1-O-tert-butyl 3-O-[(E)-3-phenylprop-2-enoyl] 2-(4-phenylphenyl)propanedioate Traditional Name: 2-(4-phenylphenyl)malonic acid O1-tert-butyl ester O3-[(E)-3-phenylacryloyl] ester Formula: C28H26O5 MolecularWeight: 442.50304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C1=CC=C(C=C1)C2=CC=CC=C2)C(=O)OC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)C(C1=CC=C(C=C1)C2=CC=CC=C2)C(=O)OC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C28H26O5/c1-28(2,3)33-27(31)25(23-17-15-22(16-18-23)21-12-8-5-9-13-21)26(30)32-24(29)19-14-20-10-6-4-7-11-20/h4-19,25H,1-3H3/b19-14+