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

Systemtic Name: (3-ethoxy-2-oxidanyl-phenyl)methyl-(pyridin-4-ylmethyl)-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)azanium Openeye Name: (3-ethoxy-2-hydroxy-phenyl)methyl-(4-pyridylmethyl)-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)ammonium CAS Name: (3-ethoxy-2-hydroxyphenyl)methyl-(pyridin-4-ylmethyl)-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)ammonium IUPAC Name: (3-ethoxy-2-hydroxyphenyl)methyl-(pyridin-4-ylmethyl)-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)azanium Traditional Name: (3-ethoxy-2-hydroxy-benzyl)-(4-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=CC=CC(=C1O)C[NH+](CC2=CC=NC=C2)C3CC([NH2+]C(C3)(C)C)(C)C

Isomeric SMILES

CCOC1=CC=CC(=C1O)C[NH+](CC2=CC=NC=C2)C3CC([NH2+]C(C3)(C)C)(C)C

InChI

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