[5-(4-tert-butylphenyl)-3-ethoxy-1,2,4-triazol-1-yl]-(2-chlorophenyl)methanone

Systemtic Name: [5-(4-tert-butylphenyl)-3-ethoxy-1,2,4-triazol-1-yl]-(2-chlorophenyl)methanone Openeye Name: [5-(4-tert-butylphenyl)-3-ethoxy-1,2,4-triazol-1-yl]-(2-chlorophenyl)methanone CAS Name: [5-(4-tert-butylphenyl)-3-ethoxy-1,2,4-triazol-1-yl]-(2-chlorophenyl)methanone IUPAC Name: [5-(4-tert-butylphenyl)-3-ethoxy-1,2,4-triazol-1-yl]-(2-chlorophenyl)methanone Traditional Name: [5-(4-tert-butylphenyl)-3-ethoxy-1,2,4-triazol-1-yl]-(2-chlorophenyl)methanone Formula: C21H22ClN3O2 MolecularWeight: 383.87128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN(C(=N1)C2=CC=C(C=C2)C(C)(C)C)C(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CCOC1=NN(C(=N1)C2=CC=C(C=C2)C(C)(C)C)C(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C21H22ClN3O2/c1-5-27-20-23-18(14-10-12-15(13-11-14)21(2,3)4)25(24-20)19(26)16-8-6-7-9-17(16)22/h6-13H,5H2,1-4H3