tert-butyl 4-[3-[(3-bromophenyl)carbonylamino]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-[(3-bromophenyl)carbonylamino]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-[(3-bromobenzoyl)amino]benzoyl]piperazine-1-carboxylate CAS Name: 4-[[3-[[(3-bromophenyl)-oxomethyl]amino]phenyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-[(3-bromobenzoyl)amino]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[3-[(3-bromobenzoyl)amino]benzoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C23H26BrN3O4 MolecularWeight: 488.37424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C23H26BrN3O4/c1-23(2,3)31-22(30)27-12-10-26(11-13-27)21(29)17-7-5-9-19(15-17)25-20(28)16-6-4-8-18(24)14-16/h4-9,14-15H,10-13H2,1-3H3,(H,25,28)