methyl (2R)-3,3-dimethyl-2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]butanoate

Systemtic Name: methyl (2R)-3,3-dimethyl-2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]butanoate Openeye Name: methyl (2R)-3,3-dimethyl-2-[2-nitro-4-(trifluoromethyl)anilino]butanoate CAS Name: (2R)-3,3-dimethyl-2-[2-nitro-4-(trifluoromethyl)anilino]butanoic acid methyl ester IUPAC Name: methyl (2R)-3,3-dimethyl-2-[2-nitro-4-(trifluoromethyl)anilino]butanoate Traditional Name: (2R)-3,3-dimethyl-2-[2-nitro-4-(trifluoromethyl)anilino]butyric acid methyl ester Formula: C14H17F3N2O4 MolecularWeight: 334.29099

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17F3N2O4/c1-13(2,3)11(12(20)23-4)18-9-6-5-8(14(15,16)17)7-10(9)19(21)22/h5-7,11,18H,1-4H3/t11-/m0/s1