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

Systemtic Name: 4-[[4-(furan-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]-2,6-dimethoxy-phenol Openeye Name: 4-[[4-(2-furylmethyl)piperazine-1,4-diium-1-yl]methyl]-2,6-dimethoxy-phenol CAS Name: 4-[[4-(2-furanylmethyl)-1-piperazine-1,4-diiumyl]methyl]-2,6-dimethoxyphenol IUPAC Name: 4-[[4-(furan-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]-2,6-dimethoxyphenol Traditional Name: 4-[[4-(2-furfuryl)piperazine-1,4-diium-1-yl]methyl]-2,6-dimethoxy-phenol Formula: C18H26N2O4+2 MolecularWeight: 334.41004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)C[NH+]2CC[NH+](CC2)CC3=CC=CO3

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)C[NH+]2CC[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+2