1-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]-2-phenoxy-ethanone

Systemtic Name: 1-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]-2-phenoxy-ethanone Openeye Name: 1-[4-(2-furylmethyl)piperazin-4-ium-1-yl]-2-phenoxy-ethanone CAS Name: 1-[4-(2-furanylmethyl)-1-piperazin-4-iumyl]-2-phenoxyethanone IUPAC Name: 1-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]-2-phenoxyethanone Traditional Name: 1-[4-(2-furfuryl)piperazin-4-ium-1-yl]-2-phenoxy-ethanone Formula: C17H21N2O3+ MolecularWeight: 301.36024

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CO2)C(=O)COC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CO2)C(=O)COC3=CC=CC=C3

InChI

InChI=1S/C17H20N2O3/c20-17(14-22-15-5-2-1-3-6-15)19-10-8-18(9-11-19)13-16-7-4-12-21-16/h1-7,12H,8-11,13-14H2/p+1