N-[(2R)-2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-ium-4-yl-ethyl]-2-(trifluoromethyl)quinazolin-4-amine

Systemtic Name: N-[(2R)-2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-ium-4-yl-ethyl]-2-(trifluoromethyl)quinazolin-4-amine Openeye Name: N-[(2R)-2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-ium-4-yl-ethyl]-2-(trifluoromethyl)quinazolin-4-amine CAS Name: N-[(2R)-2-(4-ethoxy-3-methoxyphenyl)-2-(4-morpholin-4-iumyl)ethyl]-2-(trifluoromethyl)-4-quinazolinamine IUPAC Name: N-[(2R)-2-(4-ethoxy-3-methoxyphenyl)-2-morpholin-4-ium-4-ylethyl]-2-(trifluoromethyl)quinazolin-4-amine Traditional Name: [(2R)-2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-ium-4-yl-ethyl]-[2-(trifluoromethyl)quinazolin-4-yl]amine Formula: C24H28F3N4O3+ MolecularWeight: 477.49933

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(CNC2=NC(=NC3=CC=CC=C32)C(F)(F)F)[NH+]4CCOCC4)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@H](CNC2=NC(=NC3=CC=CC=C32)C(F)(F)F)[NH+]4CCOCC4)OC

InChI

InChI=1S/C24H27F3N4O3/c1-3-34-20-9-8-16(14-21(20)32-2)19(31-10-12-33-13-11-31)15-28-22-17-6-4-5-7-18(17)29-23(30-22)24(25,26)27/h4-9,14,19H,3,10-13,15H2,1-2H3,(H,28,29,30)/p+1/t19-/m0/s1