(3-ethoxy-2-oxidanyl-phenyl)methyl-methyl-[[1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-yl]methyl]azanium

Systemtic Name: (3-ethoxy-2-oxidanyl-phenyl)methyl-methyl-[[1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-yl]methyl]azanium Openeye Name: (3-ethoxy-2-hydroxy-phenyl)methyl-methyl-[[1-[(5-methyl-2-furyl)methyl]piperidin-1-ium-4-yl]methyl]ammonium CAS Name: (3-ethoxy-2-hydroxyphenyl)methyl-methyl-[[1-[(5-methyl-2-furanyl)methyl]-4-piperidin-1-iumyl]methyl]ammonium IUPAC Name: (3-ethoxy-2-hydroxyphenyl)methyl-methyl-[[1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-yl]methyl]azanium Traditional Name: (3-ethoxy-2-hydroxy-benzyl)-methyl-[[1-[(5-methyl-2-furyl)methyl]piperidin-1-ium-4-yl]methyl]ammonium Formula: C22H34N2O3+2 MolecularWeight: 374.51696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1O)C[NH+](C)CC2CC[NH+](CC2)CC3=CC=C(O3)C

Isomeric SMILES

CCOC1=CC=CC(=C1O)C[NH+](C)CC2CC[NH+](CC2)CC3=CC=C(O3)C

InChI

InChI=1S/C22H32N2O3/c1-4-26-21-7-5-6-19(22(21)25)15-23(3)14-18-10-12-24(13-11-18)16-20-9-8-17(2)27-20/h5-9,18,25H,4,10-16H2,1-3H3/p+2