tert-butyl 4-[3-(2-oxidanylideneimidazolidin-1-yl)phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-(2-oxidanylideneimidazolidin-1-yl)phenyl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-(2-oxoimidazolidin-1-yl)benzoyl]piperazine-1-carboxylate CAS Name: 4-[oxo-[3-(2-oxo-1-imidazolidinyl)phenyl]methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(2-oxoimidazolidin-1-yl)benzoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(2-ketoimidazolidin-1-yl)benzoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C19H26N4O4 MolecularWeight: 374.43414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)N3CCNC3=O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)N3CCNC3=O

InChI

InChI=1S/C19H26N4O4/c1-19(2,3)27-18(26)22-11-9-21(10-12-22)16(24)14-5-4-6-15(13-14)23-8-7-20-17(23)25/h4-6,13H,7-12H2,1-3H3,(H,20,25)