2-[4-(thiophen-3-ylmethyl)piperazine-1,4-diium-1-yl]ethanol

Systemtic Name: 2-[4-(thiophen-3-ylmethyl)piperazine-1,4-diium-1-yl]ethanol Openeye Name: 2-[4-(3-thienylmethyl)piperazine-1,4-diium-1-yl]ethanol CAS Name: 2-[4-(3-thiophenylmethyl)-1-piperazine-1,4-diiumyl]ethanol IUPAC Name: 2-[4-(thiophen-3-ylmethyl)piperazine-1,4-diium-1-yl]ethanol Traditional Name: 2-[4-(3-thenyl)piperazine-1,4-diium-1-yl]ethanol Formula: C11H20N2OS+2 MolecularWeight: 228.3543

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CCO)CC2=CSC=C2

Isomeric SMILES

C1C[NH+](CC[NH+]1CCO)CC2=CSC=C2

InChI

InChI=1S/C11H18N2OS/c14-7-6-12-2-4-13(5-3-12)9-11-1-8-15-10-11/h1,8,10,14H,2-7,9H2/p+2