1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-ium-1-yl]ethanone

Systemtic Name: 1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-ium-1-yl]ethanone Openeye Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-ium-1-yl]ethanone CAS Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[(3R)-3-(trifluoromethyl)-1-piperidin-1-iumyl]ethanone IUPAC Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-ium-1-yl]ethanone Traditional Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-ium-1-yl]ethanone Formula: C16H22F3N2O2+ MolecularWeight: 331.35329

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)C[NH+]2CCCC(C2)C(F)(F)F

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)C[NH+]2CCC[C@H](C2)C(F)(F)F

InChI

InChI=1S/C16H21F3N2O2/c1-9-14(11(3)22)10(2)20-15(9)13(23)8-21-6-4-5-12(7-21)16(17,18)19/h12,20H,4-8H2,1-3H3/p+1/t12-/m1/s1