tert-butyl N-[2-[(5-fluoranyl-2-nitro-phenyl)carbonylamino]ethyl]carbamate

Systemtic Name: tert-butyl N-[2-[(5-fluoranyl-2-nitro-phenyl)carbonylamino]ethyl]carbamate Openeye Name: tert-butyl N-[2-[(5-fluoro-2-nitro-benzoyl)amino]ethyl]carbamate CAS Name: N-[2-[[(5-fluoro-2-nitrophenyl)-oxomethyl]amino]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[(5-fluoro-2-nitrobenzoyl)amino]ethyl]carbamate Traditional Name: N-[2-[(5-fluoro-2-nitro-benzoyl)amino]ethyl]carbamic acid tert-butyl ester Formula: C14H18FN3O5 MolecularWeight: 327.308223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCNC(=O)C1=C(C=CC(=C1)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NCCNC(=O)C1=C(C=CC(=C1)F)[N+](=O)[O-]

InChI

InChI=1S/C14H18FN3O5/c1-14(2,3)23-13(20)17-7-6-16-12(19)10-8-9(15)4-5-11(10)18(21)22/h4-5,8H,6-7H2,1-3H3,(H,16,19)(H,17,20)