ditert-butyl 2-[(E,1R)-1,3-diphenylprop-2-enyl]propanedioate

Systemtic Name: ditert-butyl 2-[(E,1R)-1,3-diphenylprop-2-enyl]propanedioate Openeye Name: ditert-butyl 2-[(E,1R)-1,3-diphenylallyl]propanedioate CAS Name: 2-[(E,1R)-1,3-diphenylprop-2-enyl]propanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-[(E,1R)-1,3-diphenylprop-2-enyl]propanedioate Traditional Name: 2-[(E,1R)-1,3-diphenylallyl]malonic acid ditert-butyl ester Formula: C26H32O4 MolecularWeight: 408.52988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)OC(=O)C([C@@H](/C=C/C1=CC=CC=C1)C2=CC=CC=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H32O4/c1-25(2,3)29-23(27)22(24(28)30-26(4,5)6)21(20-15-11-8-12-16-20)18-17-19-13-9-7-10-14-19/h7-18,21-22H,1-6H3/b18-17+/t21-/m0/s1