methyl 3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propanoate

Systemtic Name: methyl 3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propanoate Openeye Name: methyl 3-[2-nitro-4-(trifluoromethyl)anilino]propanoate CAS Name: 3-[2-nitro-4-(trifluoromethyl)anilino]propanoic acid methyl ester IUPAC Name: methyl 3-[2-nitro-4-(trifluoromethyl)anilino]propanoate Traditional Name: 3-[2-nitro-4-(trifluoromethyl)anilino]propionic acid methyl ester Formula: C11H11F3N2O4 MolecularWeight: 292.21125

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCNC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C11H11F3N2O4/c1-20-10(17)4-5-15-8-3-2-7(11(12,13)14)6-9(8)16(18)19/h2-3,6,15H,4-5H2,1H3