1,3-benzodioxol-4-ylmethyl-methyl-[[1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-yl]methyl]azanium

Systemtic Name: 1,3-benzodioxol-4-ylmethyl-methyl-[[1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-yl]methyl]azanium Openeye Name: 1,3-benzodioxol-4-ylmethyl-methyl-[[1-[(5-methyl-2-furyl)methyl]piperidin-1-ium-4-yl]methyl]ammonium CAS Name: 1,3-benzodioxol-4-ylmethyl-methyl-[[1-[(5-methyl-2-furanyl)methyl]-4-piperidin-1-iumyl]methyl]ammonium IUPAC Name: 1,3-benzodioxol-4-ylmethyl-methyl-[[1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-yl]methyl]azanium Traditional Name: 1,3-benzodioxol-4-ylmethyl-methyl-[[1-[(5-methyl-2-furyl)methyl]piperidin-1-ium-4-yl]methyl]ammonium Formula: C21H30N2O3+2 MolecularWeight: 358.4745

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH+]2CCC(CC2)C[NH+](C)CC3=C4C(=CC=C3)OCO4

Isomeric SMILES

CC1=CC=C(O1)C[NH+]2CCC(CC2)C[NH+](C)CC3=C4C(=CC=C3)OCO4

InChI

InChI=1S/C21H28N2O3/c1-16-6-7-19(26-16)14-23-10-8-17(9-11-23)12-22(2)13-18-4-3-5-20-21(18)25-15-24-20/h3-7,17H,8-15H2,1-2H3/p+2