2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]-N-[(1R)-1-thiophen-2-ylethyl]ethanamide

Systemtic Name: 2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]-N-[(1R)-1-thiophen-2-ylethyl]ethanamide Openeye Name: 2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]-N-[(1R)-1-(2-thienyl)ethyl]acetamide CAS Name: 2-[4-(2-ethoxyphenyl)-1-piperazin-1-iumyl]-N-[(1R)-1-thiophen-2-ylethyl]acetamide IUPAC Name: 2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]-N-[(1R)-1-thiophen-2-ylethyl]acetamide Traditional Name: 2-(4-o-phenetylpiperazin-1-ium-1-yl)-N-[(1R)-1-(2-thienyl)ethyl]acetamide Formula: C20H28N3O2S+ MolecularWeight: 374.52022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)NC(C)C3=CC=CS3

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)N[C@H](C)C3=CC=CS3

InChI

InChI=1S/C20H27N3O2S/c1-3-25-18-8-5-4-7-17(18)23-12-10-22(11-13-23)15-20(24)21-16(2)19-9-6-14-26-19/h4-9,14,16H,3,10-13,15H2,1-2H3,(H,21,24)/p+1/t16-/m1/s1