ditert-butyl 2-[phenyl(phenylmethoxycarbonylamino)methyl]propanedioate

Systemtic Name: ditert-butyl 2-[phenyl(phenylmethoxycarbonylamino)methyl]propanedioate Openeye Name: ditert-butyl 2-[benzyloxycarbonylamino(phenyl)methyl]propanedioate CAS Name: 2-[phenyl(phenylmethoxycarbonylamino)methyl]propanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-[phenyl(phenylmethoxycarbonylamino)methyl]propanedioate Traditional Name: 2-[benzyloxycarbonylamino(phenyl)methyl]malonic acid ditert-butyl ester Formula: C26H33NO6 MolecularWeight: 455.54332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C(C1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C(C(C1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H33NO6/c1-25(2,3)32-22(28)20(23(29)33-26(4,5)6)21(19-15-11-8-12-16-19)27-24(30)31-17-18-13-9-7-10-14-18/h7-16,20-21H,17H2,1-6H3,(H,27,30)