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

Systemtic Name: N-(2-methylpentyl)-2-nitro-4-(trifluoromethyl)aniline Openeye Name: N-(2-methylpentyl)-2-nitro-4-(trifluoromethyl)aniline CAS Name: N-(2-methylpentyl)-2-nitro-4-(trifluoromethyl)aniline IUPAC Name: N-(2-methylpentyl)-2-nitro-4-(trifluoromethyl)aniline Traditional Name: 2-methylpentyl-[2-nitro-4-(trifluoromethyl)phenyl]amine Formula: C13H17F3N2O2 MolecularWeight: 290.28149

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)CNC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCCC(C)CNC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]

InChI

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