tert-butyl 4-(4-chloranyl-2-oxidanylidene-3H-benzimidazol-1-yl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(4-chloranyl-2-oxidanylidene-3H-benzimidazol-1-yl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(4-chloro-2-oxo-3H-benzimidazol-1-yl)piperidine-1-carboxylate CAS Name: 4-(4-chloro-2-oxo-3H-benzimidazol-1-yl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-chloro-2-oxo-3H-benzimidazol-1-yl)piperidine-1-carboxylate Traditional Name: 4-(4-chloro-2-keto-3H-benzimidazol-1-yl)piperidine-1-carboxylic acid tert-butyl ester Formula: C17H22ClN3O3 MolecularWeight: 351.82788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)N2C3=C(C(=CC=C3)Cl)NC2=O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N2C3=C(C(=CC=C3)Cl)NC2=O

InChI

InChI=1S/C17H22ClN3O3/c1-17(2,3)24-16(23)20-9-7-11(8-10-20)21-13-6-4-5-12(18)14(13)19-15(21)22/h4-6,11H,7-10H2,1-3H3,(H,19,22)