tert-butyl 4-[(4-cyano-2-methoxy-5-nitro-phenoxy)methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(4-cyano-2-methoxy-5-nitro-phenoxy)methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(4-cyano-2-methoxy-5-nitro-phenoxy)methyl]piperidine-1-carboxylate CAS Name: 4-[(4-cyano-2-methoxy-5-nitrophenoxy)methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(4-cyano-2-methoxy-5-nitrophenoxy)methyl]piperidine-1-carboxylate Traditional Name: 4-[(4-cyano-2-methoxy-5-nitro-phenoxy)methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C19H25N3O6 MolecularWeight: 391.4183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)COC2=C(C=C(C(=C2)[N+](=O)[O-])C#N)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)COC2=C(C=C(C(=C2)[N+](=O)[O-])C#N)OC

InChI

InChI=1S/C19H25N3O6/c1-19(2,3)28-18(23)21-7-5-13(6-8-21)12-27-17-10-15(22(24)25)14(11-20)9-16(17)26-4/h9-10,13H,5-8,12H2,1-4H3