tert-butyl N-[1-[(5-fluoranyl-2-nitro-phenyl)amino]-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[(5-fluoranyl-2-nitro-phenyl)amino]-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-(benzyloxymethyl)-2-(5-fluoro-2-nitro-anilino)-2-oxo-ethyl]carbamate CAS Name: N-[1-(5-fluoro-2-nitroanilino)-1-oxo-3-phenylmethoxypropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(5-fluoro-2-nitroanilino)-1-oxo-3-phenylmethoxypropan-2-yl]carbamate Traditional Name: N-[1-(benzoxymethyl)-2-(5-fluoro-2-nitro-anilino)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C21H24FN3O6 MolecularWeight: 433.430163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(COCC1=CC=CC=C1)C(=O)NC2=C(C=CC(=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC(COCC1=CC=CC=C1)C(=O)NC2=C(C=CC(=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C21H24FN3O6/c1-21(2,3)31-20(27)24-17(13-30-12-14-7-5-4-6-8-14)19(26)23-16-11-15(22)9-10-18(16)25(28)29/h4-11,17H,12-13H2,1-3H3,(H,23,26)(H,24,27)