2-nitro-N-pentyl-4-(trifluoromethyl)aniline

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCCCCNC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]

InChI

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