(5-fluoranyl-2-nitro-phenyl) 2-[methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]amino]ethanoate

Systemtic Name: (5-fluoranyl-2-nitro-phenyl) 2-[methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]amino]ethanoate Openeye Name: (5-fluoro-2-nitro-phenyl) 2-[[2-(isopropylamino)-2-oxo-ethyl]-methyl-amino]acetate CAS Name: 2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetic acid (5-fluoro-2-nitrophenyl) ester IUPAC Name: (5-fluoro-2-nitrophenyl) 2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetate Traditional Name: 2-[[2-(isopropylamino)-2-keto-ethyl]-methyl-amino]acetic acid (5-fluoro-2-nitro-phenyl) ester Formula: C14H18FN3O5 MolecularWeight: 327.308223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN(C)CC(=O)OC1=C(C=CC(=C1)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=O)CN(C)CC(=O)OC1=C(C=CC(=C1)F)[N+](=O)[O-]

InChI

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