4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1H-benzo[g][3,1]benzoxazin-2-one

Systemtic Name: 4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1H-benzo[g][3,1]benzoxazin-2-one Openeye Name: 4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1H-benzo[g][3,1]benzoxazin-2-one CAS Name: 4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1H-benzo[g][3,1]benzoxazin-2-one IUPAC Name: 4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1H-benzo[g][3,1]benzoxazin-2-one Traditional Name: 4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1H-benzo[g][3,1]benzoxazin-2-one Formula: C18H12F3NO2 MolecularWeight: 331.28859

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C#CC2(C3=CC4=CC=CC=C4C=C3NC(=O)O2)C(F)(F)F

Isomeric SMILES

C1CC1C#CC2(C3=CC4=CC=CC=C4C=C3NC(=O)O2)C(F)(F)F

InChI

InChI=1S/C18H12F3NO2/c19-18(20,21)17(8-7-11-5-6-11)14-9-12-3-1-2-4-13(12)10-15(14)22-16(23)24-17/h1-4,9-11H,5-6H2,(H,22,23)