(4S)-1-[2-(1-chloranylcyclopropyl)ethynyl]-3-oxidanyl-4-(trifluoromethyl)-4H-quinazolin-2-one

Systemtic Name: (4S)-1-[2-(1-chloranylcyclopropyl)ethynyl]-3-oxidanyl-4-(trifluoromethyl)-4H-quinazolin-2-one Openeye Name: (4S)-1-[2-(1-chlorocyclopropyl)ethynyl]-3-hydroxy-4-(trifluoromethyl)-4H-quinazolin-2-one CAS Name: (4S)-1-[2-(1-chlorocyclopropyl)ethynyl]-3-hydroxy-4-(trifluoromethyl)-4H-quinazolin-2-one IUPAC Name: (4S)-1-[2-(1-chlorocyclopropyl)ethynyl]-3-hydroxy-4-(trifluoromethyl)-4H-quinazolin-2-one Traditional Name: (4S)-1-[2-(1-chlorocyclopropyl)ethynyl]-3-hydroxy-4-(trifluoromethyl)-4H-quinazolin-2-one Formula: C14H10ClF3N2O2 MolecularWeight: 330.68961

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C#CN2C3=CC=CC=C3C(N(C2=O)O)C(F)(F)F)Cl

Isomeric SMILES

C1CC1(C#CN2C3=CC=CC=C3[C@H](N(C2=O)O)C(F)(F)F)Cl

InChI

InChI=1S/C14H10ClF3N2O2/c15-13(5-6-13)7-8-19-10-4-2-1-3-9(10)11(14(16,17)18)20(22)12(19)21/h1-4,11,22H,5-6H2/t11-/m0/s1