tert-butyl 4-(6-nitrobenzimidazol-1-yl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(6-nitrobenzimidazol-1-yl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(6-nitrobenzimidazol-1-yl)piperidine-1-carboxylate CAS Name: 4-(6-nitro-1-benzimidazolyl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(6-nitrobenzimidazol-1-yl)piperidine-1-carboxylate Traditional Name: 4-(6-nitrobenzimidazol-1-yl)piperidine-1-carboxylic acid tert-butyl ester Formula: C17H22N4O4 MolecularWeight: 346.38098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)N2C=NC3=C2C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N2C=NC3=C2C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H22N4O4/c1-17(2,3)25-16(22)19-8-6-12(7-9-19)20-11-18-14-5-4-13(21(23)24)10-15(14)20/h4-5,10-12H,6-9H2,1-3H3