2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1H-1,2,4-triazol-3-one

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1H-1,2,4-triazol-3-one Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-1H-1,2,4-triazol-3-one CAS Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-1H-1,2,4-triazol-3-one IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-1H-1,2,4-triazol-3-one Traditional Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-1H-1,2,4-triazol-3-one Formula: C16H23N3O2 MolecularWeight: 289.37272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)N2C(=O)N=CN2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)N2C(=O)N=CN2

InChI

InChI=1S/C16H23N3O2/c1-15(2,3)11-7-10(19-14(21)17-9-18-19)8-12(13(11)20)16(4,5)6/h7-9,20H,1-6H3,(H,17,18,21)