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

Systemtic Name: ethyl 1-(6-cyclohexyl-2-phenyl-quinolin-4-yl)-5-phenyl-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 1-(6-cyclohexyl-2-phenyl-4-quinolyl)-5-phenyl-triazole-4-carboxylate CAS Name: 1-(6-cyclohexyl-2-phenyl-4-quinolinyl)-5-phenyl-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(6-cyclohexyl-2-phenylquinolin-4-yl)-5-phenyltriazole-4-carboxylate Traditional Name: 1-(6-cyclohexyl-2-phenyl-4-quinolyl)-5-phenyl-triazole-4-carboxylic acid ethyl ester Formula: C32H30N4O2 MolecularWeight: 502.6062

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)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)C2=CC(=NC3=C2C=C(C=C3)C4CCCCC4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C32H30N4O2/c1-2-38-32(37)30-31(24-16-10-5-11-17-24)36(35-34-30)29-21-28(23-14-8-4-9-15-23)33-27-19-18-25(20-26(27)29)22-12-6-3-7-13-22/h4-5,8-11,14-22H,2-3,6-7,12-13H2,1H3