4-[[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]methyl]-2,6-dimethoxy-phenol

Systemtic Name: 4-[[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]methyl]-2,6-dimethoxy-phenol Openeye Name: 4-[[4-(2-furylmethyl)piperazin-4-ium-1-yl]methyl]-2,6-dimethoxy-phenol CAS Name: 4-[[4-(2-furanylmethyl)-1-piperazin-4-iumyl]methyl]-2,6-dimethoxyphenol IUPAC Name: 4-[[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]methyl]-2,6-dimethoxyphenol Traditional Name: 4-[[4-(2-furfuryl)piperazin-4-ium-1-yl]methyl]-2,6-dimethoxy-phenol Formula: C18H25N2O4+ MolecularWeight: 333.4021

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)CN2CC[NH+](CC2)CC3=CC=CO3

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)CN2CC[NH+](CC2)CC3=CC=CO3

InChI

InChI=1S/C18H24N2O4/c1-22-16-10-14(11-17(23-2)18(16)21)12-19-5-7-20(8-6-19)13-15-4-3-9-24-15/h3-4,9-11,21H,5-8,12-13H2,1-2H3/p+1