N-(2-methylpentan-3-yl)-2-nitro-4-(trifluoromethyl)aniline

Systemtic Name: N-(2-methylpentan-3-yl)-2-nitro-4-(trifluoromethyl)aniline Openeye Name: N-(1-ethyl-2-methyl-propyl)-2-nitro-4-(trifluoromethyl)aniline CAS Name: N-(2-methylpentan-3-yl)-2-nitro-4-(trifluoromethyl)aniline IUPAC Name: N-(2-methylpentan-3-yl)-2-nitro-4-(trifluoromethyl)aniline Traditional Name: (1-ethyl-2-methyl-propyl)-[2-nitro-4-(trifluoromethyl)phenyl]amine Formula: C13H17F3N2O2 MolecularWeight: 290.28149

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17F3N2O2/c1-4-10(8(2)3)17-11-6-5-9(13(14,15)16)7-12(11)18(19)20/h5-8,10,17H,4H2,1-3H3