butyl 4-[4-(1-adamantyl)phenoxy]pyridine-3-carboxylate

Systemtic Name: butyl 4-[4-(1-adamantyl)phenoxy]pyridine-3-carboxylate Openeye Name: butyl 4-[4-(1-adamantyl)phenoxy]pyridine-3-carboxylate CAS Name: 4-[4-(1-adamantyl)phenoxy]-3-pyridinecarboxylic acid butyl ester IUPAC Name: butyl 4-[4-(1-adamantyl)phenoxy]pyridine-3-carboxylate Traditional Name: 4-[4-(1-adamantyl)phenoxy]nicotinic acid butyl ester Formula: C26H31NO3 MolecularWeight: 405.52924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(C=CN=C1)OC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCCCOC(=O)C1=C(C=CN=C1)OC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H31NO3/c1-2-3-10-29-25(28)23-17-27-9-8-24(23)30-22-6-4-21(5-7-22)26-14-18-11-19(15-26)13-20(12-18)16-26/h4-9,17-20H,2-3,10-16H2,1H3