tert-butyl N-[4-[(4-fluoranyl-3-nitro-phenyl)amino]-4-oxidanylidene-butyl]carbamate

Systemtic Name: tert-butyl N-[4-[(4-fluoranyl-3-nitro-phenyl)amino]-4-oxidanylidene-butyl]carbamate Openeye Name: tert-butyl N-[4-(4-fluoro-3-nitro-anilino)-4-oxo-butyl]carbamate CAS Name: N-[4-(4-fluoro-3-nitroanilino)-4-oxobutyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-(4-fluoro-3-nitroanilino)-4-oxobutyl]carbamate Traditional Name: N-[4-(4-fluoro-3-nitro-anilino)-4-keto-butyl]carbamic acid tert-butyl ester Formula: C15H20FN3O5 MolecularWeight: 341.334803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCC(=O)NC1=CC(=C(C=C1)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NCCCC(=O)NC1=CC(=C(C=C1)F)[N+](=O)[O-]

InChI

InChI=1S/C15H20FN3O5/c1-15(2,3)24-14(21)17-8-4-5-13(20)18-10-6-7-11(16)12(9-10)19(22)23/h6-7,9H,4-5,8H2,1-3H3,(H,17,21)(H,18,20)