ethyl 1-(6-cyclohexyl-2-methyl-quinolin-4-yl)-5-methyl-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 1-(6-cyclohexyl-2-methyl-quinolin-4-yl)-5-methyl-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 1-(6-cyclohexyl-2-methyl-4-quinolyl)-5-methyl-triazole-4-carboxylate CAS Name: 1-(6-cyclohexyl-2-methyl-4-quinolinyl)-5-methyl-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(6-cyclohexyl-2-methylquinolin-4-yl)-5-methyltriazole-4-carboxylate Traditional Name: 1-(6-cyclohexyl-2-methyl-4-quinolyl)-5-methyl-triazole-4-carboxylic acid ethyl ester Formula: C22H26N4O2 MolecularWeight: 378.46744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)C2=CC(=NC3=C2C=C(C=C3)C4CCCCC4)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)C2=CC(=NC3=C2C=C(C=C3)C4CCCCC4)C)C

InChI

InChI=1S/C22H26N4O2/c1-4-28-22(27)21-15(3)26(25-24-21)20-12-14(2)23-19-11-10-17(13-18(19)20)16-8-6-5-7-9-16/h10-13,16H,4-9H2,1-3H3