2-nitro-N-pentan-2-yl-4-(trifluoromethyl)aniline

Systemtic Name: 2-nitro-N-pentan-2-yl-4-(trifluoromethyl)aniline Openeye Name: N-(1-methylbutyl)-2-nitro-4-(trifluoromethyl)aniline CAS Name: 2-nitro-N-pentan-2-yl-4-(trifluoromethyl)aniline IUPAC Name: 2-nitro-N-pentan-2-yl-4-(trifluoromethyl)aniline Traditional Name: 1-methylbutyl-[2-nitro-4-(trifluoromethyl)phenyl]amine Formula: C12H15F3N2O2 MolecularWeight: 276.25491

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15F3N2O2/c1-3-4-8(2)16-10-6-5-9(12(13,14)15)7-11(10)17(18)19/h5-8,16H,3-4H2,1-2H3