1-[1-(furan-2-ylmethyl)piperidin-1-ium-4-yl]-4-(2-methoxyphenyl)piperazin-1-ium

Systemtic Name: 1-[1-(furan-2-ylmethyl)piperidin-1-ium-4-yl]-4-(2-methoxyphenyl)piperazin-1-ium Openeye Name: 1-[1-(2-furylmethyl)piperidin-1-ium-4-yl]-4-(2-methoxyphenyl)piperazin-1-ium CAS Name: 1-[1-(2-furanylmethyl)-4-piperidin-1-iumyl]-4-(2-methoxyphenyl)piperazin-1-ium IUPAC Name: 1-[1-(furan-2-ylmethyl)piperidin-1-ium-4-yl]-4-(2-methoxyphenyl)piperazin-1-ium Traditional Name: 1-[1-(2-furfuryl)piperidin-1-ium-4-yl]-4-(2-methoxyphenyl)piperazin-1-ium Formula: C21H31N3O2+2 MolecularWeight: 357.48974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)C3CC[NH+](CC3)CC4=CC=CO4

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)C3CC[NH+](CC3)CC4=CC=CO4

InChI

InChI=1S/C21H29N3O2/c1-25-21-7-3-2-6-20(21)24-14-12-23(13-15-24)18-8-10-22(11-9-18)17-19-5-4-16-26-19/h2-7,16,18H,8-15,17H2,1H3/p+2