1-(4-prop-2-enylpiperazin-4-ium-1-yl)-2-thiophen-2-yl-ethanone

Systemtic Name: 1-(4-prop-2-enylpiperazin-4-ium-1-yl)-2-thiophen-2-yl-ethanone Openeye Name: 1-(4-allylpiperazin-4-ium-1-yl)-2-(2-thienyl)ethanone CAS Name: 1-(4-prop-2-enyl-1-piperazin-4-iumyl)-2-thiophen-2-ylethanone IUPAC Name: 1-(4-prop-2-enylpiperazin-4-ium-1-yl)-2-thiophen-2-ylethanone Traditional Name: 1-(4-allylpiperazin-4-ium-1-yl)-2-(2-thienyl)ethanone Formula: C13H19N2OS+ MolecularWeight: 251.36776

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+]1CCN(CC1)C(=O)CC2=CC=CS2

Isomeric SMILES

C=CC[NH+]1CCN(CC1)C(=O)CC2=CC=CS2

InChI

InChI=1S/C13H18N2OS/c1-2-5-14-6-8-15(9-7-14)13(16)11-12-4-3-10-17-12/h2-4,10H,1,5-9,11H2/p+1