(3-ethoxy-4-oxidanyl-phenyl)methyl-(pyridin-2-ylmethyl)-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)azanium

Systemtic Name: (3-ethoxy-4-oxidanyl-phenyl)methyl-(pyridin-2-ylmethyl)-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)azanium Openeye Name: (3-ethoxy-4-hydroxy-phenyl)methyl-(2-pyridylmethyl)-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)ammonium CAS Name: (3-ethoxy-4-hydroxyphenyl)methyl-(2-pyridinylmethyl)-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)ammonium IUPAC Name: (3-ethoxy-4-hydroxyphenyl)methyl-(pyridin-2-ylmethyl)-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)azanium Traditional Name: (3-ethoxy-4-hydroxy-benzyl)-(2-pyridylmethyl)-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)ammonium Formula: C24H37N3O2+2 MolecularWeight: 399.56948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH+](CC2=CC=CC=N2)C3CC([NH2+]C(C3)(C)C)(C)C)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH+](CC2=CC=CC=N2)C3CC([NH2+]C(C3)(C)C)(C)C)O

InChI

InChI=1S/C24H35N3O2/c1-6-29-22-13-18(10-11-21(22)28)16-27(17-19-9-7-8-12-25-19)20-14-23(2,3)26-24(4,5)15-20/h7-13,20,26,28H,6,14-17H2,1-5H3/p+2