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

Systemtic Name: 1-[2-(2-chloranylpyrrolidin-1-yl)ethynyl]-4-(trifluoromethyl)-4H-3,1-benzoxazin-2-one Openeye Name: 1-[2-(2-chloropyrrolidin-1-yl)ethynyl]-4-(trifluoromethyl)-4H-3,1-benzoxazin-2-one CAS Name: 1-[2-(2-chloro-1-pyrrolidinyl)ethynyl]-4-(trifluoromethyl)-4H-3,1-benzoxazin-2-one IUPAC Name: 1-[2-(2-chloropyrrolidin-1-yl)ethynyl]-4-(trifluoromethyl)-4H-3,1-benzoxazin-2-one Traditional Name: 1-[2-(2-chloropyrrolidino)ethynyl]-4-(trifluoromethyl)-4H-3,1-benzoxazin-2-one Formula: C15H12ClF3N2O2 MolecularWeight: 344.71619

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C#CN2C3=CC=CC=C3C(OC2=O)C(F)(F)F)Cl

Isomeric SMILES

C1CC(N(C1)C#CN2C3=CC=CC=C3C(OC2=O)C(F)(F)F)Cl

InChI

InChI=1S/C15H12ClF3N2O2/c16-12-6-3-7-20(12)8-9-21-11-5-2-1-4-10(11)13(15(17,18)19)23-14(21)22/h1-2,4-5,12-13H,3,6-7H2