3-[2-oxidanylidene-3-(3-oxidanylpiperidin-2-yl)propyl]-6-(trifluoromethyl)quinazolin-4-one dihydrobromide

Systemtic Name: 3-[2-oxidanylidene-3-(3-oxidanylpiperidin-2-yl)propyl]-6-(trifluoromethyl)quinazolin-4-one dihydrobromide Openeye Name: 3-[3-(3-hydroxy-2-piperidyl)-2-oxo-propyl]-6-(trifluoromethyl)quinazolin-4-one dihydrobromide CAS Name: 3-[3-(3-hydroxy-2-piperidinyl)-2-oxopropyl]-6-(trifluoromethyl)-4-quinazolinone dihydrobromide IUPAC Name: 3-[3-(3-hydroxypiperidin-2-yl)-2-oxopropyl]-6-(trifluoromethyl)quinazolin-4-one dihydrobromide Traditional Name: 3-[3-(3-hydroxy-2-piperidyl)-2-keto-propyl]-6-(trifluoromethyl)quinazolin-4-one dihydrobromide Formula: C17H20Br2F3N3O3 MolecularWeight: 531.16221

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(NC1)CC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)C(F)(F)F)O.Br.Br

Isomeric SMILES

C1CC(C(NC1)CC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)C(F)(F)F)O.Br.Br

InChI

InChI=1S/C17H18F3N3O3.2BrH/c18-17(19,20)10-3-4-13-12(6-10)16(26)23(9-22-13)8-11(24)7-14-15(25)2-1-5-21-14;;/h3-4,6,9,14-15,21,25H,1-2,5,7-8H2;2*1H