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4-[[2-nitro-4-(trifluoromethyl)phenyl]amino]butanoate

4-[[2-nitro-4-(trifluoromethyl)phenyl]amino]butanoate

Systemtic Name:4-[[2-nitro-4-(trifluoromethyl)phenyl]amino]butanoate
Openeye Name:4-[2-nitro-4-(trifluoromethyl)anilino]butanoate
CAS Name:4-[2-nitro-4-(trifluoromethyl)anilino]butanoate
IUPAC Name:4-[2-nitro-4-(trifluoromethyl)anilino]butanoate
Traditional Name:4-[2-nitro-4-(trifluoromethyl)anilino]butyrate
Formula: C11H10F3N2O4-
MolecularWeight: 291.20331
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])NCCCC(=O)[O-]


Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])NCCCC(=O)[O-]


InChI

InChI=1S/C11H11F3N2O4/c12-11(13,14)7-3-4-8(9(6-7)16(19)20)15-5-1-2-10(17)18/h3-4,6,15H,1-2,5H2,(H,17,18)/p-1


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