tert-butyl 4-[(4-nitro-2-propan-2-yl-1H-benzimidazol-5-yl)oxy]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(4-nitro-2-propan-2-yl-1H-benzimidazol-5-yl)oxy]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(2-isopropyl-4-nitro-1H-benzimidazol-5-yl)oxy]piperidine-1-carboxylate CAS Name: 4-[(4-nitro-2-propan-2-yl-1H-benzimidazol-5-yl)oxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(4-nitro-2-propan-2-yl-1H-benzimidazol-5-yl)oxy]piperidine-1-carboxylate Traditional Name: 4-[(2-isopropyl-4-nitro-1H-benzimidazol-5-yl)oxy]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H28N4O5 MolecularWeight: 404.46012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(N1)C=CC(=C2[N+](=O)[O-])OC3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C1=NC2=C(N1)C=CC(=C2[N+](=O)[O-])OC3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H28N4O5/c1-12(2)18-21-14-6-7-15(17(24(26)27)16(14)22-18)28-13-8-10-23(11-9-13)19(25)29-20(3,4)5/h6-7,12-13H,8-11H2,1-5H3,(H,21,22)