O4-tert-butyl O1-(phenylmethyl) (2R,5S)-2,5-dimethylpiperazine-1,4-dicarboxylate

Systemtic Name: O4-tert-butyl O1-(phenylmethyl) (2R,5S)-2,5-dimethylpiperazine-1,4-dicarboxylate Openeye Name: O1-benzyl O4-tert-butyl (2R,5S)-2,5-dimethylpiperazine-1,4-dicarboxylate CAS Name: (2R,5S)-2,5-dimethylpiperazine-1,4-dicarboxylic acid O4-tert-butyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 4-O-tert-butyl (2R,5S)-2,5-dimethylpiperazine-1,4-dicarboxylate Traditional Name: (2R,5S)-2,5-dimethylpiperazine-1,4-dicarboxylic acid O1-benzyl ester O4-tert-butyl ester Formula: C19H28N2O4 MolecularWeight: 348.43662

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(CN1C(=O)OC(C)(C)C)C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C[C@H]1CN([C@@H](CN1C(=O)OC(C)(C)C)C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H28N2O4/c1-14-12-21(18(23)25-19(3,4)5)15(2)11-20(14)17(22)24-13-16-9-7-6-8-10-16/h6-10,14-15H,11-13H2,1-5H3/t14-,15+/m1/s1