1-adamantyl-[(2-ethyl-6-methyl-3-oxidanyl-pyridin-4-yl)methyl]-methyl-azanium

Systemtic Name: 1-adamantyl-[(2-ethyl-6-methyl-3-oxidanyl-pyridin-4-yl)methyl]-methyl-azanium Openeye Name: 1-adamantyl-[(2-ethyl-3-hydroxy-6-methyl-4-pyridyl)methyl]-methyl-ammonium CAS Name: 1-adamantyl-[(2-ethyl-3-hydroxy-6-methyl-4-pyridinyl)methyl]-methylammonium IUPAC Name: 1-adamantyl-[(2-ethyl-3-hydroxy-6-methylpyridin-4-yl)methyl]-methylazanium Traditional Name: 1-adamantyl-[(2-ethyl-3-hydroxy-6-methyl-4-pyridyl)methyl]-methyl-ammonium Formula: C20H31N2O+ MolecularWeight: 315.47294

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=N1)C)C[NH+](C)C23CC4CC(C2)CC(C4)C3)O

Isomeric SMILES

CCC1=C(C(=CC(=N1)C)C[NH+](C)C23CC4CC(C2)CC(C4)C3)O

InChI

InChI=1S/C20H30N2O/c1-4-18-19(23)17(5-13(2)21-18)12-22(3)20-9-14-6-15(10-20)8-16(7-14)11-20/h5,14-16,23H,4,6-12H2,1-3H3/p+1