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[2-oxidanylidene-2-[3-(trifluoromethyl)phenyl]ethyl] 4-(methylamino)-3-nitro-benzoate

[2-oxidanylidene-2-[3-(trifluoromethyl)phenyl]ethyl] 4-(methylamino)-3-nitro-benzoate

Systemtic Name:[2-oxidanylidene-2-[3-(trifluoromethyl)phenyl]ethyl] 4-(methylamino)-3-nitro-benzoate
Openeye Name:[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl] 4-(methylamino)-3-nitro-benzoate
CAS Name:4-(methylamino)-3-nitrobenzoic acid [2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl] ester
IUPAC Name:[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl] 4-(methylamino)-3-nitrobenzoate
Traditional Name:4-(methylamino)-3-nitro-benzoic acid [2-keto-2-[3-(trifluoromethyl)phenyl]ethyl] ester
Formula: C17H13F3N2O5
MolecularWeight: 382.29073
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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)OCC(=O)C2=CC(=CC=C2)C(F)(F)F)[N+](=O)[O-]


Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)OCC(=O)C2=CC(=CC=C2)C(F)(F)F)[N+](=O)[O-]


InChI

InChI=1S/C17H13F3N2O5/c1-21-13-6-5-11(8-14(13)22(25)26)16(24)27-9-15(23)10-3-2-4-12(7-10)17(18,19)20/h2-8,21H,9H2,1H3


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