5-[4-(2,3,5-trimethyl-4-oxidanyl-phenoxy)phenyl]-1,2-dihydro-1,2,4-triazol-3-one

Systemtic Name: 5-[4-(2,3,5-trimethyl-4-oxidanyl-phenoxy)phenyl]-1,2-dihydro-1,2,4-triazol-3-one Openeye Name: 5-[4-(4-hydroxy-2,3,5-trimethyl-phenoxy)phenyl]-1,2-dihydro-1,2,4-triazol-3-one CAS Name: 5-[4-(4-hydroxy-2,3,5-trimethylphenoxy)phenyl]-1,2-dihydro-1,2,4-triazol-3-one IUPAC Name: 5-[4-(4-hydroxy-2,3,5-trimethylphenoxy)phenyl]-1,2-dihydro-1,2,4-triazol-3-one Traditional Name: 5-[4-(4-hydroxy-2,3,5-trimethyl-phenoxy)phenyl]-1,2-dihydro-1,2,4-triazol-3-one Formula: C17H17N3O3 MolecularWeight: 311.33518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1O)C)C)OC2=CC=C(C=C2)C3=NC(=O)NN3

Isomeric SMILES

CC1=CC(=C(C(=C1O)C)C)OC2=CC=C(C=C2)C3=NC(=O)NN3

InChI

InChI=1S/C17H17N3O3/c1-9-8-14(10(2)11(3)15(9)21)23-13-6-4-12(5-7-13)16-18-17(22)20-19-16/h4-8,21H,1-3H3,(H2,18,19,20,22)