O4-tert-butyl O1-(phenylmethyl) 2-(2-methoxy-2-oxidanylidene-ethyl)piperazine-1,4-dicarboxylate

Systemtic Name: O4-tert-butyl O1-(phenylmethyl) 2-(2-methoxy-2-oxidanylidene-ethyl)piperazine-1,4-dicarboxylate Openeye Name: O1-benzyl O4-tert-butyl 2-(2-methoxy-2-oxo-ethyl)piperazine-1,4-dicarboxylate CAS Name: 2-(2-methoxy-2-oxoethyl)piperazine-1,4-dicarboxylic acid O4-tert-butyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 4-O-tert-butyl 2-(2-methoxy-2-oxoethyl)piperazine-1,4-dicarboxylate Traditional Name: 2-(2-keto-2-methoxy-ethyl)piperazine-1,4-dicarboxylic acid O1-benzyl ester O4-tert-butyl ester Formula: C20H28N2O6 MolecularWeight: 392.44612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(C(C1)CC(=O)OC)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(C(C1)CC(=O)OC)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H28N2O6/c1-20(2,3)28-18(24)21-10-11-22(16(13-21)12-17(23)26-4)19(25)27-14-15-8-6-5-7-9-15/h5-9,16H,10-14H2,1-4H3