2,2,2-tris(fluoranyl)ethanoyl 2-azanyl-6-[(2-nitrophenyl)amino]hexanoate

Systemtic Name: 2,2,2-tris(fluoranyl)ethanoyl 2-azanyl-6-[(2-nitrophenyl)amino]hexanoate Openeye Name: (2,2,2-trifluoroacetyl) 2-amino-6-(2-nitroanilino)hexanoate CAS Name: 2-amino-6-(2-nitroanilino)hexanoic acid (2,2,2-trifluoro-1-oxoethyl) ester IUPAC Name: (2,2,2-trifluoroacetyl) 2-amino-6-(2-nitroanilino)hexanoate Traditional Name: 2-amino-6-(2-nitroanilino)hexanoic acid (2,2,2-trifluoroacetyl) ester Formula: C14H16F3N3O5 MolecularWeight: 363.28915

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16F3N3O5/c15-14(16,17)13(22)25-12(21)9(18)5-3-4-8-19-10-6-1-2-7-11(10)20(23)24/h1-2,6-7,9,19H,3-5,8,18H2