tert-butyl 4-[[5-[(1S)-1-phenylethoxy]carbonyl-1H-imidazol-4-yl]carbonyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[[5-[(1S)-1-phenylethoxy]carbonyl-1H-imidazol-4-yl]carbonyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[5-[(1S)-1-phenylethoxy]carbonyl-1H-imidazole-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[oxo-[5-[oxo-[(1S)-1-phenylethoxy]methyl]-1H-imidazol-4-yl]methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[5-[(1S)-1-phenylethoxy]carbonyl-1H-imidazole-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[5-[(1S)-1-phenylethoxy]carbonyl-1H-imidazole-4-carbonyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C22H28N4O5 MolecularWeight: 428.48152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC(=O)C2=C(N=CN2)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)OC(=O)C2=C(N=CN2)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H28N4O5/c1-15(16-8-6-5-7-9-16)30-20(28)18-17(23-14-24-18)19(27)25-10-12-26(13-11-25)21(29)31-22(2,3)4/h5-9,14-15H,10-13H2,1-4H3,(H,23,24)/t15-/m0/s1