2-(morpholin-4-ium-4-ylmethyl)-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one

Systemtic Name: 2-(morpholin-4-ium-4-ylmethyl)-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one Openeye Name: 2-(morpholin-4-ium-4-ylmethyl)-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one CAS Name: 2-(4-morpholin-4-iumylmethyl)-3-[3-(trifluoromethyl)phenyl]-4-quinazolinone IUPAC Name: 2-(morpholin-4-ium-4-ylmethyl)-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one Traditional Name: 2-(morpholin-4-ium-4-ylmethyl)-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one Formula: C20H19F3N3O2+ MolecularWeight: 390.37897

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1COCC[NH+]1CC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C20H18F3N3O2/c21-20(22,23)14-4-3-5-15(12-14)26-18(13-25-8-10-28-11-9-25)24-17-7-2-1-6-16(17)19(26)27/h1-7,12H,8-11,13H2/p+1