N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]-4-(trifluoromethyloxy)benzamide

Systemtic Name: N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]-4-(trifluoromethyloxy)benzamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-4-(trifluoromethoxy)benzamide CAS Name: N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]-4-(trifluoromethoxy)benzamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-4-(trifluoromethoxy)benzamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-4-(trifluoromethoxy)benzamide Formula: C19H20F3N2O2+ MolecularWeight: 365.36951

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1NC(=O)C2=CC=C(C=C2)OC(F)(F)F)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](C[C@H]1NC(=O)C2=CC=C(C=C2)OC(F)(F)F)CC3=CC=CC=C3

InChI

InChI=1S/C19H19F3N2O2/c20-19(21,22)26-17-8-6-15(7-9-17)18(25)23-16-10-11-24(13-16)12-14-4-2-1-3-5-14/h1-9,16H,10-13H2,(H,23,25)/p+1/t16-/m0/s1