ethyl 2-(1-adamantyl)-6-methyl-quinoline-4-carboxylate

Systemtic Name: ethyl 2-(1-adamantyl)-6-methyl-quinoline-4-carboxylate Openeye Name: ethyl 2-(1-adamantyl)-6-methyl-quinoline-4-carboxylate CAS Name: 2-(1-adamantyl)-6-methyl-4-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(1-adamantyl)-6-methylquinoline-4-carboxylate Traditional Name: 2-(1-adamantyl)-6-methyl-cinchoninic acid ethyl ester Formula: C23H27NO2 MolecularWeight: 349.46598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NC2=C1C=C(C=C2)C)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC(=O)C1=CC(=NC2=C1C=C(C=C2)C)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H27NO2/c1-3-26-22(25)19-10-21(24-20-5-4-14(2)6-18(19)20)23-11-15-7-16(12-23)9-17(8-15)13-23/h4-6,10,15-17H,3,7-9,11-13H2,1-2H3