2-adamantyl-[[2-[methyl(2-pyridin-2-ylethyl)amino]pyridin-1-ium-3-yl]methyl]azanium

Systemtic Name: 2-adamantyl-[[2-[methyl(2-pyridin-2-ylethyl)amino]pyridin-1-ium-3-yl]methyl]azanium Openeye Name: 2-adamantyl-[[2-[methyl-[2-(2-pyridyl)ethyl]amino]pyridin-1-ium-3-yl]methyl]ammonium CAS Name: 2-adamantyl-[[2-[methyl-[2-(2-pyridinyl)ethyl]amino]-3-pyridin-1-iumyl]methyl]ammonium IUPAC Name: 2-adamantyl-[[2-[methyl(2-pyridin-2-ylethyl)amino]pyridin-1-ium-3-yl]methyl]azanium Traditional Name: 2-adamantyl-[[2-[methyl-[2-(2-pyridyl)ethyl]amino]pyridin-1-ium-3-yl]methyl]ammonium Formula: C24H34N4+2 MolecularWeight: 378.55356

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=N1)C2=C(C=CC=[NH+]2)C[NH2+]C3C4CC5CC(C4)CC3C5

Isomeric SMILES

CN(CCC1=CC=CC=N1)C2=C(C=CC=[NH+]2)C[NH2+]C3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C24H32N4/c1-28(10-7-22-6-2-3-8-25-22)24-19(5-4-9-26-24)16-27-23-20-12-17-11-18(14-20)15-21(23)13-17/h2-6,8-9,17-18,20-21,23,27H,7,10-16H2,1H3/p+2