N-[(1R,2R)-1-pyrrolidin-1-ium-1-yl-1-thiophen-2-yl-propan-2-yl]-4-(trifluoromethyl)benzamide

Systemtic Name: N-[(1R,2R)-1-pyrrolidin-1-ium-1-yl-1-thiophen-2-yl-propan-2-yl]-4-(trifluoromethyl)benzamide Openeye Name: N-[(1R,2R)-1-methyl-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]-4-(trifluoromethyl)benzamide CAS Name: N-[(1R,2R)-1-(1-pyrrolidin-1-iumyl)-1-thiophen-2-ylpropan-2-yl]-4-(trifluoromethyl)benzamide IUPAC Name: N-[(1R,2R)-1-pyrrolidin-1-ium-1-yl-1-thiophen-2-ylpropan-2-yl]-4-(trifluoromethyl)benzamide Traditional Name: N-[(1R,2R)-1-methyl-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]-4-(trifluoromethyl)benzamide Formula: C19H22F3N2OS+ MolecularWeight: 383.45099

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CS1)[NH+]2CCCC2)NC(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C[C@H]([C@H](C1=CC=CS1)[NH+]2CCCC2)NC(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H21F3N2OS/c1-13(17(16-5-4-12-26-16)24-10-2-3-11-24)23-18(25)14-6-8-15(9-7-14)19(20,21)22/h4-9,12-13,17H,2-3,10-11H2,1H3,(H,23,25)/p+1/t13-,17-/m1/s1