tert-butyl 4-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)cyclohexyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)cyclohexyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-(2-oxo-3H-benzimidazol-1-yl)cyclohexyl]piperazine-1-carboxylate CAS Name: 4-[4-(2-oxo-3H-benzimidazol-1-yl)cyclohexyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(2-oxo-3H-benzimidazol-1-yl)cyclohexyl]piperazine-1-carboxylate Traditional Name: 4-[4-(2-keto-3H-benzimidazol-1-yl)cyclohexyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C22H32N4O3 MolecularWeight: 400.51448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2CCC(CC2)N3C4=CC=CC=C4NC3=O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2CCC(CC2)N3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C22H32N4O3/c1-22(2,3)29-21(28)25-14-12-24(13-15-25)16-8-10-17(11-9-16)26-19-7-5-4-6-18(19)23-20(26)27/h4-7,16-17H,8-15H2,1-3H3,(H,23,27)