2-(1-adamantyl)ethyl pyridine-3-carboxylate

Systemtic Name: 2-(1-adamantyl)ethyl pyridine-3-carboxylate Openeye Name: 2-(1-adamantyl)ethyl pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid 2-(1-adamantyl)ethyl ester IUPAC Name: 2-(1-adamantyl)ethyl pyridine-3-carboxylate Traditional Name: nicotinic acid 2-(1-adamantyl)ethyl ester Formula: C18H23NO2 MolecularWeight: 285.38072

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CCOC(=O)C4=CN=CC=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CCOC(=O)C4=CN=CC=C4

InChI

InChI=1S/C18H23NO2/c20-17(16-2-1-4-19-12-16)21-5-3-18-9-13-6-14(10-18)8-15(7-13)11-18/h1-2,4,12-15H,3,5-11H2