(3-ethoxy-5-phenyl-1,2,4-triazol-1-yl)-(4-hexylphenyl)methanone

Systemtic Name: (3-ethoxy-5-phenyl-1,2,4-triazol-1-yl)-(4-hexylphenyl)methanone Openeye Name: (3-ethoxy-5-phenyl-1,2,4-triazol-1-yl)-(4-hexylphenyl)methanone CAS Name: (3-ethoxy-5-phenyl-1,2,4-triazol-1-yl)-(4-hexylphenyl)methanone IUPAC Name: (3-ethoxy-5-phenyl-1,2,4-triazol-1-yl)-(4-hexylphenyl)methanone Traditional Name: (3-ethoxy-5-phenyl-1,2,4-triazol-1-yl)-(4-hexylphenyl)methanone Formula: C23H27N3O2 MolecularWeight: 377.47938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N2C(=NC(=N2)OCC)C3=CC=CC=C3

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N2C(=NC(=N2)OCC)C3=CC=CC=C3

InChI

InChI=1S/C23H27N3O2/c1-3-5-6-8-11-18-14-16-20(17-15-18)22(27)26-21(19-12-9-7-10-13-19)24-23(25-26)28-4-2/h7,9-10,12-17H,3-6,8,11H2,1-2H3