4-(azepan-1-yl)-6-[1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yloxy]-N-(3-nitrophenyl)-1,3,5-triazin-2-amine

Systemtic Name: 4-(azepan-1-yl)-6-[1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yloxy]-N-(3-nitrophenyl)-1,3,5-triazin-2-amine Openeye Name: 4-(azepan-1-yl)-N-(3-nitrophenyl)-6-[2,2,2-trifluoro-1-(trifluoromethyl)ethoxy]-1,3,5-triazin-2-amine CAS Name: 4-(1-azepanyl)-6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-(3-nitrophenyl)-1,3,5-triazin-2-amine IUPAC Name: 4-(azepan-1-yl)-6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-(3-nitrophenyl)-1,3,5-triazin-2-amine Traditional Name: [4-(azepan-1-yl)-6-[2,2,2-trifluoro-1-(trifluoromethyl)ethoxy]-s-triazin-2-yl]-(3-nitrophenyl)amine Formula: C18H18F6N6O3 MolecularWeight: 480.364339

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=NC(=N2)OC(C(F)(F)F)C(F)(F)F)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=NC(=NC(=N2)OC(C(F)(F)F)C(F)(F)F)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18F6N6O3/c19-17(20,21)13(18(22,23)24)33-16-27-14(25-11-6-5-7-12(10-11)30(31)32)26-15(28-16)29-8-3-1-2-4-9-29/h5-7,10,13H,1-4,8-9H2,(H,25,26,27,28)