ethyl 2-(1-adamantyl)quinoline-6-carboxylate

Systemtic Name: ethyl 2-(1-adamantyl)quinoline-6-carboxylate Openeye Name: ethyl 2-(1-adamantyl)quinoline-6-carboxylate CAS Name: 2-(1-adamantyl)-6-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(1-adamantyl)quinoline-6-carboxylate Traditional Name: 2-(1-adamantyl)quinoline-6-carboxylic acid ethyl ester Formula: C22H25NO2 MolecularWeight: 335.4394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N=C(C=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(C=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H25NO2/c1-2-25-21(24)18-3-5-19-17(10-18)4-6-20(23-19)22-11-14-7-15(12-22)9-16(8-14)13-22/h3-6,10,14-16H,2,7-9,11-13H2,1H3