6,8-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)-2-(trifluoromethyl)quinazolin-4-amine

Systemtic Name: 6,8-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)-2-(trifluoromethyl)quinazolin-4-amine Openeye Name: 6,8-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)-2-(trifluoromethyl)quinazolin-4-amine CAS Name: 6,8-dimethyl-N-[2-(4-morpholin-4-iumyl)ethyl]-2-(trifluoromethyl)-4-quinazolinamine IUPAC Name: 6,8-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)-2-(trifluoromethyl)quinazolin-4-amine Traditional Name: [6,8-dimethyl-2-(trifluoromethyl)quinazolin-4-yl]-(2-morpholin-4-ium-4-ylethyl)amine Formula: C17H22F3N4O+ MolecularWeight: 355.37799

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=NC(=N2)C(F)(F)F)NCC[NH+]3CCOCC3)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=NC(=N2)C(F)(F)F)NCC[NH+]3CCOCC3)C

InChI

InChI=1S/C17H21F3N4O/c1-11-9-12(2)14-13(10-11)15(23-16(22-14)17(18,19)20)21-3-4-24-5-7-25-8-6-24/h9-10H,3-8H2,1-2H3,(H,21,22,23)/p+1