2-(1-adamantyl)ethyl 2-pyridin-1-ium-1-ylethanoate

Systemtic Name: 2-(1-adamantyl)ethyl 2-pyridin-1-ium-1-ylethanoate Openeye Name: 2-(1-adamantyl)ethyl 2-pyridin-1-ium-1-ylacetate CAS Name: 2-(1-pyridin-1-iumyl)acetic acid 2-(1-adamantyl)ethyl ester IUPAC Name: 2-(1-adamantyl)ethyl 2-pyridin-1-ium-1-ylacetate Traditional Name: 2-pyridin-1-ium-1-ylacetic acid 2-(1-adamantyl)ethyl ester Formula: C19H26NO2+ MolecularWeight: 300.41524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26NO2/c21-18(14-20-5-2-1-3-6-20)22-7-4-19-11-15-8-16(12-19)10-17(9-15)13-19/h1-3,5-6,15-17H,4,7-14H2/q+1