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(4-nitrophenyl) (2S)-2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propanoate

(4-nitrophenyl) (2S)-2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propanoate

Systemtic Name:(4-nitrophenyl) (2S)-2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propanoate
Openeye Name:(4-nitrophenyl) (2S)-2-[2-nitro-4-(trifluoromethyl)anilino]propanoate
CAS Name:(2S)-2-[2-nitro-4-(trifluoromethyl)anilino]propanoic acid (4-nitrophenyl) ester
IUPAC Name:(4-nitrophenyl) (2S)-2-[2-nitro-4-(trifluoromethyl)anilino]propanoate
Traditional Name:(2S)-2-[2-nitro-4-(trifluoromethyl)anilino]propionic acid (4-nitrophenyl) ester
Formula: C16H12F3N3O6
MolecularWeight: 399.27819
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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])NC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]


Isomeric SMILES

C[C@@H](C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])NC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]


InChI

InChI=1S/C16H12F3N3O6/c1-9(15(23)28-12-5-3-11(4-6-12)21(24)25)20-13-7-2-10(16(17,18)19)8-14(13)22(26)27/h2-9,20H,1H3/t9-/m0/s1


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