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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17F3N2O2/c1-8(2)6-9(3)17-10-4-5-12(18(19)20)11(7-10)13(14,15)16/h4-5,7-9,17H,6H2,1-3H3