(5-ethylthiophen-3-yl)-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (5-ethylthiophen-3-yl)-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (5-ethyl-3-thienyl)-[4-(2-furylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (5-ethyl-3-thiophenyl)-[4-(2-furanylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (5-ethylthiophen-3-yl)-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: (5-ethyl-3-thienyl)-[4-(2-furfuryl)piperazin-4-ium-1-yl]methanone Formula: C16H21N2O2S+ MolecularWeight: 305.41514

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CS1)C(=O)N2CC[NH+](CC2)CC3=CC=CO3

Isomeric SMILES

CCC1=CC(=CS1)C(=O)N2CC[NH+](CC2)CC3=CC=CO3

InChI

InChI=1S/C16H20N2O2S/c1-2-15-10-13(12-21-15)16(19)18-7-5-17(6-8-18)11-14-4-3-9-20-14/h3-4,9-10,12H,2,5-8,11H2,1H3/p+1