1-ethyl-2-methyl-4-(4-thiophen-2-ylhexyl)piperazin-1-ium-1-carbonitrile

Systemtic Name: 1-ethyl-2-methyl-4-(4-thiophen-2-ylhexyl)piperazin-1-ium-1-carbonitrile Openeye Name: 1-ethyl-2-methyl-4-[4-(2-thienyl)hexyl]piperazin-1-ium-1-carbonitrile CAS Name: 1-ethyl-2-methyl-4-(4-thiophen-2-ylhexyl)-1-piperazin-1-iumcarbonitrile IUPAC Name: 1-ethyl-2-methyl-4-(4-thiophen-2-ylhexyl)piperazin-1-ium-1-carbonitrile Traditional Name: 1-ethyl-2-methyl-4-[4-(2-thienyl)hexyl]piperazin-1-ium-1-carbonitrile Formula: C18H30N3S+ MolecularWeight: 320.5159

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCN1CC[N+](C(C1)C)(CC)C#N)C2=CC=CS2

Isomeric SMILES

CCC(CCCN1CC[N+](C(C1)C)(CC)C#N)C2=CC=CS2

InChI

InChI=1S/C18H30N3S/c1-4-17(18-9-7-13-22-18)8-6-10-20-11-12-21(5-2,15-19)16(3)14-20/h7,9,13,16-17H,4-6,8,10-12,14H2,1-3H3/q+1