tert-butyl 4-[5-(3-bromophenyl)-2-oxidanylidene-1H-imidazol-3-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[5-(3-bromophenyl)-2-oxidanylidene-1H-imidazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[5-(3-bromophenyl)-2-oxo-1H-imidazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[5-(3-bromophenyl)-2-oxo-1H-imidazol-3-yl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[5-(3-bromophenyl)-2-oxo-1H-imidazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(3-bromophenyl)-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(CC1)N2C=C(NC2=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N2C=C(NC2=O)C3=CC(=CC=C3)Br

InChI

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