tert-butyl 4-(3-bromophenyl)-2-(2-oxidanylidene-1H-imidazol-3-yl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(3-bromophenyl)-2-(2-oxidanylidene-1H-imidazol-3-yl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(3-bromophenyl)-2-(2-oxo-1H-imidazol-3-yl)piperidine-1-carboxylate CAS Name: 4-(3-bromophenyl)-2-(2-oxo-1H-imidazol-3-yl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-bromophenyl)-2-(2-oxo-1H-imidazol-3-yl)piperidine-1-carboxylate Traditional Name: 4-(3-bromophenyl)-2-(2-keto-4-imidazolin-1-yl)piperidine-1-carboxylic acid tert-butyl ester Formula: C19H24BrN3O3 MolecularWeight: 422.31616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1N2C=CNC2=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1N2C=CNC2=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C19H24BrN3O3/c1-19(2,3)26-18(25)23-9-7-14(13-5-4-6-15(20)11-13)12-16(23)22-10-8-21-17(22)24/h4-6,8,10-11,14,16H,7,9,12H2,1-3H3,(H,21,24)