2-(4-chlorophenyl)-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-3-yl-ethyl]ethanamide

Systemtic Name: 2-(4-chlorophenyl)-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-3-yl-ethyl]ethanamide Openeye Name: 2-(4-chlorophenyl)-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(3-thienyl)ethyl]acetamide CAS Name: 2-(4-chlorophenyl)-N-[(2S)-2-(1-pyrrolidin-1-iumyl)-2-(3-thiophenyl)ethyl]acetamide IUPAC Name: 2-(4-chlorophenyl)-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-3-ylethyl]acetamide Traditional Name: 2-(4-chlorophenyl)-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(3-thienyl)ethyl]acetamide Formula: C18H22ClN2OS+ MolecularWeight: 349.89808

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)CC2=CC=C(C=C2)Cl)C3=CSC=C3

Isomeric SMILES

C1CC[NH+](C1)[C@H](CNC(=O)CC2=CC=C(C=C2)Cl)C3=CSC=C3

InChI

InChI=1S/C18H21ClN2OS/c19-16-5-3-14(4-6-16)11-18(22)20-12-17(15-7-10-23-13-15)21-8-1-2-9-21/h3-7,10,13,17H,1-2,8-9,11-12H2,(H,20,22)/p+1/t17-/m1/s1