naphthalen-2-yl 2-(1-adamantyl)pyridine-4-carboxylate

Systemtic Name: naphthalen-2-yl 2-(1-adamantyl)pyridine-4-carboxylate Openeye Name: 2-naphthyl 2-(1-adamantyl)pyridine-4-carboxylate CAS Name: 2-(1-adamantyl)-4-pyridinecarboxylic acid 2-naphthalenyl ester IUPAC Name: naphthalen-2-yl 2-(1-adamantyl)pyridine-4-carboxylate Traditional Name: 2-(1-adamantyl)isonicotinic acid 2-naphthyl ester Formula: C26H25NO2 MolecularWeight: 383.4822

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NC=CC(=C4)C(=O)OC5=CC6=CC=CC=C6C=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NC=CC(=C4)C(=O)OC5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C26H25NO2/c28-25(29-23-6-5-20-3-1-2-4-21(20)12-23)22-7-8-27-24(13-22)26-14-17-9-18(15-26)11-19(10-17)16-26/h1-8,12-13,17-19H,9-11,14-16H2