N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-2-(trifluoromethyl)quinazolin-4-amine

Systemtic Name: N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-2-(trifluoromethyl)quinazolin-4-amine Openeye Name: N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-2-(trifluoromethyl)quinazolin-4-amine CAS Name: N-[[1-(4-morpholin-4-iumyl)cyclohexyl]methyl]-2-(trifluoromethyl)-4-quinazolinamine IUPAC Name: N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-2-(trifluoromethyl)quinazolin-4-amine Traditional Name: (1-morpholin-4-ium-4-ylcyclohexyl)methyl-[2-(trifluoromethyl)quinazolin-4-yl]amine Formula: C20H26F3N4O+ MolecularWeight: 395.44185

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC2=NC(=NC3=CC=CC=C32)C(F)(F)F)[NH+]4CCOCC4

Isomeric SMILES

C1CCC(CC1)(CNC2=NC(=NC3=CC=CC=C32)C(F)(F)F)[NH+]4CCOCC4

InChI

InChI=1S/C20H25F3N4O/c21-20(22,23)18-25-16-7-3-2-6-15(16)17(26-18)24-14-19(8-4-1-5-9-19)27-10-12-28-13-11-27/h2-3,6-7H,1,4-5,8-14H2,(H,24,25,26)/p+1