6-tert-butyl-1-ethanoyl-7-oxidanyl-2H-indazol-4-one

Systemtic Name: 6-tert-butyl-1-ethanoyl-7-oxidanyl-2H-indazol-4-one Openeye Name: 1-acetyl-6-tert-butyl-7-hydroxy-2H-indazol-4-one CAS Name: 1-acetyl-6-tert-butyl-7-hydroxy-2H-indazol-4-one IUPAC Name: 1-acetyl-6-tert-butyl-7-hydroxy-2H-indazol-4-one Traditional Name: 1-acetyl-6-tert-butyl-7-hydroxy-2H-indazol-4-one Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C2=C(C(=CC(=O)C2=CN1)C(C)(C)C)O

Isomeric SMILES

CC(=O)N1C2=C(C(=CC(=O)C2=CN1)C(C)(C)C)O

InChI

InChI=1S/C13H16N2O3/c1-7(16)15-11-8(6-14-15)10(17)5-9(12(11)18)13(2,3)4/h5-6,14,18H,1-4H3