1-[2-methyl-3-oxidanyl-1-[4-(trifluoromethyl)phenyl]pyrrolidin-1-ium-1-yl]propan-2-one

Systemtic Name: 1-[2-methyl-3-oxidanyl-1-[4-(trifluoromethyl)phenyl]pyrrolidin-1-ium-1-yl]propan-2-one Openeye Name: 1-[3-hydroxy-2-methyl-1-[4-(trifluoromethyl)phenyl]pyrrolidin-1-ium-1-yl]propan-2-one CAS Name: 1-[3-hydroxy-2-methyl-1-[4-(trifluoromethyl)phenyl]-1-pyrrolidin-1-iumyl]-2-propanone IUPAC Name: 1-[3-hydroxy-2-methyl-1-[4-(trifluoromethyl)phenyl]pyrrolidin-1-ium-1-yl]propan-2-one Traditional Name: 1-[3-hydroxy-2-methyl-1-[4-(trifluoromethyl)phenyl]pyrrolidin-1-ium-1-yl]acetone Formula: C15H19F3NO2+ MolecularWeight: 302.31207

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CC[N+]1(CC(=O)C)C2=CC=C(C=C2)C(F)(F)F)O

Isomeric SMILES

CC1C(CC[N+]1(CC(=O)C)C2=CC=C(C=C2)C(F)(F)F)O

InChI

InChI=1S/C15H19F3NO2/c1-10(20)9-19(8-7-14(21)11(19)2)13-5-3-12(4-6-13)15(16,17)18/h3-6,11,14,21H,7-9H2,1-2H3/q+1