1-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)-2-[(3S)-3-(trifluoromethyl)piperidin-1-ium-1-yl]ethanone

Systemtic Name: 1-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)-2-[(3S)-3-(trifluoromethyl)piperidin-1-ium-1-yl]ethanone Openeye Name: 1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]-2-[(3S)-3-(trifluoromethyl)piperidin-1-ium-1-yl]ethanone CAS Name: 1-[5-[oxo(1-pyrrolidinyl)methyl]-1H-pyrrol-3-yl]-2-[(3S)-3-(trifluoromethyl)-1-piperidin-1-iumyl]ethanone IUPAC Name: 1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]-2-[(3S)-3-(trifluoromethyl)piperidin-1-ium-1-yl]ethanone Traditional Name: 1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]-2-[(3S)-3-(trifluoromethyl)piperidin-1-ium-1-yl]ethanone Formula: C17H23F3N3O2+ MolecularWeight: 358.37863

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC(=CN2)C(=O)C[NH+]3CCCC(C3)C(F)(F)F

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC(=CN2)C(=O)C[NH+]3CCC[C@@H](C3)C(F)(F)F

InChI

InChI=1S/C17H22F3N3O2/c18-17(19,20)13-4-3-5-22(10-13)11-15(24)12-8-14(21-9-12)16(25)23-6-1-2-7-23/h8-9,13,21H,1-7,10-11H2/p+1/t13-/m0/s1