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

Systemtic Name: [4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]-(5-propylthiophen-3-yl)methanone Openeye Name: [4-(2-furylmethyl)piperazin-4-ium-1-yl]-(5-propyl-3-thienyl)methanone CAS Name: [4-(2-furanylmethyl)-1-piperazin-4-iumyl]-(5-propyl-3-thiophenyl)methanone IUPAC Name: [4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]-(5-propylthiophen-3-yl)methanone Traditional Name: [4-(2-furfuryl)piperazin-4-ium-1-yl]-(5-propyl-3-thienyl)methanone Formula: C17H23N2O2S+ MolecularWeight: 319.44172

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CS1)C(=O)N2CC[NH+](CC2)CC3=CC=CO3

Isomeric SMILES

CCCC1=CC(=CS1)C(=O)N2CC[NH+](CC2)CC3=CC=CO3

InChI

InChI=1S/C17H22N2O2S/c1-2-4-16-11-14(13-22-16)17(20)19-8-6-18(7-9-19)12-15-5-3-10-21-15/h3,5,10-11,13H,2,4,6-9,12H2,1H3/p+1