2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2-thiophen-2-ylethyl)ethanamide

Systemtic Name: 2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2-thiophen-2-ylethyl)ethanamide Openeye Name: 2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-[2-(2-thienyl)ethyl]acetamide CAS Name: 2-[4-[(4-methoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]-N-(2-thiophen-2-ylethyl)acetamide IUPAC Name: 2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2-thiophen-2-ylethyl)acetamide Traditional Name: 2-(4-p-anisylpiperazine-1,4-diium-1-yl)-N-[2-(2-thienyl)ethyl]acetamide Formula: C20H29N3O2S+2 MolecularWeight: 375.52816

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)CC(=O)NCCC3=CC=CS3

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)CC(=O)NCCC3=CC=CS3

InChI

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