(2S)-2-[(4-nitrophenyl)amino]-N-[(2S)-2-[2,2,2-tris(fluoranyl)ethanoylamino]propanoyl]propanamide

Systemtic Name: (2S)-2-[(4-nitrophenyl)amino]-N-[(2S)-2-[2,2,2-tris(fluoranyl)ethanoylamino]propanoyl]propanamide Openeye Name: (2S)-2-(4-nitroanilino)-N-[(2S)-2-[(2,2,2-trifluoroacetyl)amino]propanoyl]propanamide CAS Name: (2S)-2-(4-nitroanilino)-N-[(2S)-1-oxo-2-[(2,2,2-trifluoro-1-oxoethyl)amino]propyl]propanamide IUPAC Name: (2S)-2-(4-nitroanilino)-N-[(2S)-2-[(2,2,2-trifluoroacetyl)amino]propanoyl]propanamide Traditional Name: (2S)-2-(4-nitroanilino)-N-[(2S)-2-[(2,2,2-trifluoroacetyl)amino]propanoyl]propionamide Formula: C14H15F3N4O5 MolecularWeight: 376.28791

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C(=O)NC(=O)[C@H](C)NC(=O)C(F)(F)F)NC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C14H15F3N4O5/c1-7(18-9-3-5-10(6-4-9)21(25)26)11(22)20-12(23)8(2)19-13(24)14(15,16)17/h3-8,18H,1-2H3,(H,19,24)(H,20,22,23)/t7-,8-/m0/s1