N-[2-(4-methoxyphenyl)ethyl]-2-[4-(thiophen-2-ylmethyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[2-(4-methoxyphenyl)ethyl]-2-[4-(thiophen-2-ylmethyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[2-(4-methoxyphenyl)ethyl]-2-[4-(2-thienylmethyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[2-(4-methoxyphenyl)ethyl]-2-[4-(thiophen-2-ylmethyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[2-(4-methoxyphenyl)ethyl]-2-[4-(thiophen-2-ylmethyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[2-(4-methoxyphenyl)ethyl]-2-[4-(2-thenyl)piperazin-1-ium-1-yl]acetamide Formula: C20H28N3O2S+ MolecularWeight: 374.52022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)C[NH+]2CCN(CC2)CC3=CC=CS3

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)C[NH+]2CCN(CC2)CC3=CC=CS3

InChI

InChI=1S/C20H27N3O2S/c1-25-18-6-4-17(5-7-18)8-9-21-20(24)16-23-12-10-22(11-13-23)15-19-3-2-14-26-19/h2-7,14H,8-13,15-16H2,1H3,(H,21,24)/p+1