5-(3-methoxyphenyl)-4,4-bis(oxidanyl)-2-propan-2-yl-pyrazol-3-one

Systemtic Name: 5-(3-methoxyphenyl)-4,4-bis(oxidanyl)-2-propan-2-yl-pyrazol-3-one Openeye Name: 4,4-dihydroxy-2-isopropyl-5-(3-methoxyphenyl)pyrazol-3-one CAS Name: 4,4-dihydroxy-5-(3-methoxyphenyl)-2-propan-2-yl-3-pyrazolone IUPAC Name: 4,4-dihydroxy-5-(3-methoxyphenyl)-2-propan-2-ylpyrazol-3-one Traditional Name: 4,4-dihydroxy-2-isopropyl-5-(3-methoxyphenyl)-2-pyrazolin-3-one Formula: C13H16N2O4 MolecularWeight: 264.27714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C(C(=N1)C2=CC(=CC=C2)OC)(O)O

Isomeric SMILES

CC(C)N1C(=O)C(C(=N1)C2=CC(=CC=C2)OC)(O)O

InChI

InChI=1S/C13H16N2O4/c1-8(2)15-12(16)13(17,18)11(14-15)9-5-4-6-10(7-9)19-3/h4-8,17-18H,1-3H3