tert-butyl 4-[1-(2-bromophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[1-(2-bromophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[1-(2-bromophenyl)-5-oxo-pyrrolidine-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[1-(2-bromophenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-(2-bromophenyl)-5-oxopyrrolidine-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[1-(2-bromophenyl)-5-keto-pyrrolidine-3-carbonyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C20H26BrN3O4 MolecularWeight: 452.34214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2CC(=O)N(C2)C3=CC=CC=C3Br

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2CC(=O)N(C2)C3=CC=CC=C3Br

InChI

InChI=1S/C20H26BrN3O4/c1-20(2,3)28-19(27)23-10-8-22(9-11-23)18(26)14-12-17(25)24(13-14)16-7-5-4-6-15(16)21/h4-7,14H,8-13H2,1-3H3