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1-adamantylmethyl 2-pyridin-1-ium-1-ylethanoate

1-adamantylmethyl 2-pyridin-1-ium-1-ylethanoate

Systemtic Name:1-adamantylmethyl 2-pyridin-1-ium-1-ylethanoate
Openeye Name:1-adamantylmethyl 2-pyridin-1-ium-1-ylacetate
CAS Name:2-(1-pyridin-1-iumyl)acetic acid 1-adamantylmethyl ester
IUPAC Name:1-adamantylmethyl 2-pyridin-1-ium-1-ylacetate
Traditional Name:2-pyridin-1-ium-1-ylacetic acid 1-adamantylmethyl ester
Formula: C18H24NO2+
MolecularWeight: 286.38866
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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)COC(=O)C[N+]4=CC=CC=C4


Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)COC(=O)C[N+]4=CC=CC=C4


InChI

InChI=1S/C18H24NO2/c20-17(12-19-4-2-1-3-5-19)21-13-18-9-14-6-15(10-18)8-16(7-14)11-18/h1-5,14-16H,6-13H2/q+1


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