ditert-butyl 2-[(2-oxidanylidene-2-phenylmethoxy-ethyl)carbamoyl]piperazine-1,4-dicarboxylate

Systemtic Name: ditert-butyl 2-[(2-oxidanylidene-2-phenylmethoxy-ethyl)carbamoyl]piperazine-1,4-dicarboxylate Openeye Name: ditert-butyl 2-[(2-benzyloxy-2-oxo-ethyl)carbamoyl]piperazine-1,4-dicarboxylate CAS Name: 2-[oxo-[(2-oxo-2-phenylmethoxyethyl)amino]methyl]piperazine-1,4-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-[(2-oxo-2-phenylmethoxyethyl)carbamoyl]piperazine-1,4-dicarboxylate Traditional Name: 2-[(2-benzoxy-2-keto-ethyl)carbamoyl]piperazine-1,4-dicarboxylic acid ditert-butyl ester Formula: C24H35N3O7 MolecularWeight: 477.5506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H35N3O7/c1-23(2,3)33-21(30)26-12-13-27(22(31)34-24(4,5)6)18(15-26)20(29)25-14-19(28)32-16-17-10-8-7-9-11-17/h7-11,18H,12-16H2,1-6H3,(H,25,29)