O4-tert-butyl O1-(phenylmethyl) (2S)-2-methylpiperazine-1,4-dicarboxylate

Systemtic Name: O4-tert-butyl O1-(phenylmethyl) (2S)-2-methylpiperazine-1,4-dicarboxylate Openeye Name: O1-benzyl O4-tert-butyl (2S)-2-methylpiperazine-1,4-dicarboxylate CAS Name: (2S)-2-methylpiperazine-1,4-dicarboxylic acid O4-tert-butyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 4-O-tert-butyl (2S)-2-methylpiperazine-1,4-dicarboxylate Traditional Name: (2S)-2-methylpiperazine-1,4-dicarboxylic acid O1-benzyl ester O4-tert-butyl ester Formula: C18H26N2O4 MolecularWeight: 334.41004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)OCC2=CC=CC=C2)C(=O)OC(C)(C)C

Isomeric SMILES

C[C@H]1CN(CCN1C(=O)OCC2=CC=CC=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H26N2O4/c1-14-12-19(16(21)24-18(2,3)4)10-11-20(14)17(22)23-13-15-8-6-5-7-9-15/h5-9,14H,10-13H2,1-4H3/t14-/m0/s1