1-(3-nitrophenyl)-N-[2,2,2-tris(fluoranyl)ethyl]butan-1-amine

Systemtic Name: 1-(3-nitrophenyl)-N-[2,2,2-tris(fluoranyl)ethyl]butan-1-amine Openeye Name: 1-(3-nitrophenyl)-N-(2,2,2-trifluoroethyl)butan-1-amine CAS Name: 1-(3-nitrophenyl)-N-(2,2,2-trifluoroethyl)-1-butanamine IUPAC Name: 1-(3-nitrophenyl)-N-(2,2,2-trifluoroethyl)butan-1-amine Traditional Name: 1-(3-nitrophenyl)butyl-(2,2,2-trifluoroethyl)amine Formula: C12H15F3N2O2 MolecularWeight: 276.25491

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC(=CC=C1)[N+](=O)[O-])NCC(F)(F)F

Isomeric SMILES

CCCC(C1=CC(=CC=C1)[N+](=O)[O-])NCC(F)(F)F

InChI

InChI=1S/C12H15F3N2O2/c1-2-4-11(16-8-12(13,14)15)9-5-3-6-10(7-9)17(18)19/h3,5-7,11,16H,2,4,8H2,1H3