ethyl 1-(6-cyclohexylquinolin-4-yl)-5-phenyl-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 1-(6-cyclohexylquinolin-4-yl)-5-phenyl-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 1-(6-cyclohexyl-4-quinolyl)-5-phenyl-triazole-4-carboxylate CAS Name: 1-(6-cyclohexyl-4-quinolinyl)-5-phenyl-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(6-cyclohexylquinolin-4-yl)-5-phenyltriazole-4-carboxylate Traditional Name: 1-(6-cyclohexyl-4-quinolyl)-5-phenyl-triazole-4-carboxylic acid ethyl ester Formula: C26H26N4O2 MolecularWeight: 426.51024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)C2=C3C=C(C=CC3=NC=C2)C4CCCCC4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)C2=C3C=C(C=CC3=NC=C2)C4CCCCC4)C5=CC=CC=C5

InChI

InChI=1S/C26H26N4O2/c1-2-32-26(31)24-25(19-11-7-4-8-12-19)30(29-28-24)23-15-16-27-22-14-13-20(17-21(22)23)18-9-5-3-6-10-18/h4,7-8,11-18H,2-3,5-6,9-10H2,1H3