2-(1-adamantylsulfanyl)-1-methyl-pyridin-1-ium

Systemtic Name: 2-(1-adamantylsulfanyl)-1-methyl-pyridin-1-ium Openeye Name: 2-(1-adamantylsulfanyl)-1-methyl-pyridin-1-ium CAS Name: 2-(1-adamantylthio)-1-methylpyridin-1-ium IUPAC Name: 2-(1-adamantylsulfanyl)-1-methylpyridin-1-ium Traditional Name: 2-(1-adamantylthio)-1-methyl-pyridin-1-ium Formula: C16H22NS+ MolecularWeight: 260.41758

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1SC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[N+]1=CC=CC=C1SC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C16H22NS/c1-17-5-3-2-4-15(17)18-16-9-12-6-13(10-16)8-14(7-12)11-16/h2-5,12-14H,6-11H2,1H3/q+1