N-(4-methoxyphenyl)-4-[[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]benzamide

Systemtic Name: N-(4-methoxyphenyl)-4-[[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]benzamide Openeye Name: N-(4-methoxyphenyl)-4-[[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]methyl]benzamide CAS Name: N-(4-methoxyphenyl)-4-[[(2R)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]methyl]benzamide IUPAC Name: N-(4-methoxyphenyl)-4-[[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]benzamide Traditional Name: N-(4-methoxyphenyl)-4-[[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]methyl]benzamide Formula: C23H25N2O2S+ MolecularWeight: 393.5218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C[NH+]3CCCC3C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C[NH+]3CCC[C@@H]3C4=CC=CS4

InChI

InChI=1S/C23H24N2O2S/c1-27-20-12-10-19(11-13-20)24-23(26)18-8-6-17(7-9-18)16-25-14-2-4-21(25)22-5-3-15-28-22/h3,5-13,15,21H,2,4,14,16H2,1H3,(H,24,26)/p+1/t21-/m1/s1