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

Systemtic Name: O4-tert-butyl O1-(phenylmethyl) (2S)-2-aminocarbonylpiperazine-1,4-dicarboxylate Openeye Name: O1-benzyl O4-tert-butyl (2S)-2-carbamoylpiperazine-1,4-dicarboxylate CAS Name: (2S)-2-carbamoylpiperazine-1,4-dicarboxylic acid O4-tert-butyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 4-O-tert-butyl (2S)-2-carbamoylpiperazine-1,4-dicarboxylate Traditional Name: (2S)-2-carbamoylpiperazine-1,4-dicarboxylic acid O1-benzyl ester O4-tert-butyl ester Formula: C18H25N3O5 MolecularWeight: 363.4082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN([C@@H](C1)C(=O)N)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H25N3O5/c1-18(2,3)26-16(23)20-9-10-21(14(11-20)15(19)22)17(24)25-12-13-7-5-4-6-8-13/h4-8,14H,9-12H2,1-3H3,(H2,19,22)/t14-/m0/s1