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

Systemtic Name: tert-butyl 4-(3,4-dichlorophenyl)-2-(2-oxidanylidene-1H-imidazol-3-yl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(3,4-dichlorophenyl)-2-(2-oxo-1H-imidazol-3-yl)piperidine-1-carboxylate CAS Name: 4-(3,4-dichlorophenyl)-2-(2-oxo-1H-imidazol-3-yl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3,4-dichlorophenyl)-2-(2-oxo-1H-imidazol-3-yl)piperidine-1-carboxylate Traditional Name: 4-(3,4-dichlorophenyl)-2-(2-keto-4-imidazolin-1-yl)piperidine-1-carboxylic acid tert-butyl ester Formula: C19H23Cl2N3O3 MolecularWeight: 412.31022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23Cl2N3O3/c1-19(2,3)27-18(26)24-8-6-13(12-4-5-14(20)15(21)10-12)11-16(24)23-9-7-22-17(23)25/h4-5,7,9-10,13,16H,6,8,11H2,1-3H3,(H,22,25)