tert-butyl 4-(3-fluoranyl-2-nitro-phenoxy)piperidine-4-carboxylate

Systemtic Name: tert-butyl 4-(3-fluoranyl-2-nitro-phenoxy)piperidine-4-carboxylate Openeye Name: tert-butyl 4-(3-fluoro-2-nitro-phenoxy)piperidine-4-carboxylate CAS Name: 4-(3-fluoro-2-nitrophenoxy)-4-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-fluoro-2-nitrophenoxy)piperidine-4-carboxylate Traditional Name: 4-(3-fluoro-2-nitro-phenoxy)isonipecotic acid tert-butyl ester Formula: C16H21FN2O5 MolecularWeight: 340.346743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1(CCNCC1)OC2=C(C(=CC=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)C1(CCNCC1)OC2=C(C(=CC=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C16H21FN2O5/c1-15(2,3)24-14(20)16(7-9-18-10-8-16)23-12-6-4-5-11(17)13(12)19(21)22/h4-6,18H,7-10H2,1-3H3