1-(1-adamantyl)-2-(2-azanyl-4-methyl-pyridin-1-ium-1-yl)ethanone

Systemtic Name: 1-(1-adamantyl)-2-(2-azanyl-4-methyl-pyridin-1-ium-1-yl)ethanone Openeye Name: 1-(1-adamantyl)-2-(2-amino-4-methyl-pyridin-1-ium-1-yl)ethanone CAS Name: 1-(1-adamantyl)-2-(2-amino-4-methyl-1-pyridin-1-iumyl)ethanone IUPAC Name: 1-(1-adamantyl)-2-(2-amino-4-methylpyridin-1-ium-1-yl)ethanone Traditional Name: 1-(1-adamantyl)-2-(2-amino-4-methyl-pyridin-1-ium-1-yl)ethanone Formula: C18H25N2O+ MolecularWeight: 285.4039

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](C=C1)CC(=O)C23CC4CC(C2)CC(C4)C3)N

Isomeric SMILES

CC1=CC(=[N+](C=C1)CC(=O)C23CC4CC(C2)CC(C4)C3)N

InChI

InChI=1S/C18H24N2O/c1-12-2-3-20(17(19)4-12)11-16(21)18-8-13-5-14(9-18)7-15(6-13)10-18/h2-4,13-15,19H,5-11H2,1H3/p+1