2-(4-chloranyl-3-methyl-phenoxy)-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]ethanamide

Systemtic Name: 2-(4-chloranyl-3-methyl-phenoxy)-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]ethanamide Openeye Name: 2-(4-chloro-3-methyl-phenoxy)-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]acetamide CAS Name: 2-(4-chloro-3-methylphenoxy)-N-[(2R)-2-(1-pyrrolidin-1-iumyl)-2-thiophen-2-ylethyl]acetamide IUPAC Name: 2-(4-chloro-3-methylphenoxy)-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-ylethyl]acetamide Traditional Name: 2-(4-chloro-3-methyl-phenoxy)-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]acetamide Formula: C19H24ClN2O2S+ MolecularWeight: 379.92406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NCC(C2=CC=CS2)[NH+]3CCCC3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NC[C@H](C2=CC=CS2)[NH+]3CCCC3)Cl

InChI

InChI=1S/C19H23ClN2O2S/c1-14-11-15(6-7-16(14)20)24-13-19(23)21-12-17(18-5-4-10-25-18)22-8-2-3-9-22/h4-7,10-11,17H,2-3,8-9,12-13H2,1H3,(H,21,23)/p+1/t17-/m1/s1