1-[2-(1-chloranylcyclohexyl)ethynyl]-4-(trifluoromethyl)-4H-3,1-benzoxazin-2-one

Systemtic Name: 1-[2-(1-chloranylcyclohexyl)ethynyl]-4-(trifluoromethyl)-4H-3,1-benzoxazin-2-one Openeye Name: 1-[2-(1-chlorocyclohexyl)ethynyl]-4-(trifluoromethyl)-4H-3,1-benzoxazin-2-one CAS Name: 1-[2-(1-chlorocyclohexyl)ethynyl]-4-(trifluoromethyl)-4H-3,1-benzoxazin-2-one IUPAC Name: 1-[2-(1-chlorocyclohexyl)ethynyl]-4-(trifluoromethyl)-4H-3,1-benzoxazin-2-one Traditional Name: 1-[2-(1-chlorocyclohexyl)ethynyl]-4-(trifluoromethyl)-4H-3,1-benzoxazin-2-one Formula: C17H15ClF3NO2 MolecularWeight: 357.75471

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#CN2C3=CC=CC=C3C(OC2=O)C(F)(F)F)Cl

Isomeric SMILES

C1CCC(CC1)(C#CN2C3=CC=CC=C3C(OC2=O)C(F)(F)F)Cl

InChI

InChI=1S/C17H15ClF3NO2/c18-16(8-4-1-5-9-16)10-11-22-13-7-3-2-6-12(13)14(17(19,20)21)24-15(22)23/h2-3,6-7,14H,1,4-5,8-9H2