(3-ethoxy-4-oxidanyl-phenyl)methyl-[(5-methylfuran-2-yl)methyl]-(pyridin-2-ylmethyl)azanium

Systemtic Name: (3-ethoxy-4-oxidanyl-phenyl)methyl-[(5-methylfuran-2-yl)methyl]-(pyridin-2-ylmethyl)azanium Openeye Name: (3-ethoxy-4-hydroxy-phenyl)methyl-[(5-methyl-2-furyl)methyl]-(2-pyridylmethyl)ammonium CAS Name: (3-ethoxy-4-hydroxyphenyl)methyl-[(5-methyl-2-furanyl)methyl]-(2-pyridinylmethyl)ammonium IUPAC Name: (3-ethoxy-4-hydroxyphenyl)methyl-[(5-methylfuran-2-yl)methyl]-(pyridin-2-ylmethyl)azanium Traditional Name: (3-ethoxy-4-hydroxy-benzyl)-[(5-methyl-2-furyl)methyl]-(2-pyridylmethyl)ammonium Formula: C21H25N2O3+ MolecularWeight: 353.4348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH+](CC2=CC=CC=N2)CC3=CC=C(O3)C)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH+](CC2=CC=CC=N2)CC3=CC=C(O3)C)O

InChI

InChI=1S/C21H24N2O3/c1-3-25-21-12-17(8-10-20(21)24)13-23(14-18-6-4-5-11-22-18)15-19-9-7-16(2)26-19/h4-12,24H,3,13-15H2,1-2H3/p+1