tert-butyl 2-[2-fluoranyl-3-oxidanyl-4-(phenylmethoxycarbonylamino)phenyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 2-[2-fluoranyl-3-oxidanyl-4-(phenylmethoxycarbonylamino)phenyl]piperidine-1-carboxylate Openeye Name: tert-butyl 2-[4-(benzyloxycarbonylamino)-2-fluoro-3-hydroxy-phenyl]piperidine-1-carboxylate CAS Name: 2-[2-fluoro-3-hydroxy-4-(phenylmethoxycarbonylamino)phenyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-fluoro-3-hydroxy-4-(phenylmethoxycarbonylamino)phenyl]piperidine-1-carboxylate Traditional Name: 2-[4-(benzyloxycarbonylamino)-2-fluoro-3-hydroxy-phenyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C24H29FN2O5 MolecularWeight: 444.495863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCCC1C2=C(C(=C(C=C2)NC(=O)OCC3=CC=CC=C3)O)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCCC1C2=C(C(=C(C=C2)NC(=O)OCC3=CC=CC=C3)O)F

InChI

InChI=1S/C24H29FN2O5/c1-24(2,3)32-23(30)27-14-8-7-11-19(27)17-12-13-18(21(28)20(17)25)26-22(29)31-15-16-9-5-4-6-10-16/h4-6,9-10,12-13,19,28H,7-8,11,14-15H2,1-3H3,(H,26,29)