2-[4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-ium-1-yl]-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanone

Systemtic Name: 2-[4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-ium-1-yl]-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanone Openeye Name: 2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-ium-1-yl]-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone CAS Name: 2-[4-[2-(4-chlorophenoxy)ethyl]-1-piperazin-1-iumyl]-1-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-ium-1-yl]-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone Traditional Name: 2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-ium-1-yl]-1-[4-(2-thenoyl)piperazino]ethanone Formula: C23H30ClN4O3S+ MolecularWeight: 478.0273

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N2CCN(CC2)C(=O)C3=CC=CS3)CCOC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N2CCN(CC2)C(=O)C3=CC=CS3)CCOC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H29ClN4O3S/c24-19-3-5-20(6-4-19)31-16-15-25-7-9-26(10-8-25)18-22(29)27-11-13-28(14-12-27)23(30)21-2-1-17-32-21/h1-6,17H,7-16,18H2/p+1