5-tert-butyl-4,4-bis(oxidanyl)-2-(2-phenoxyethyl)pyrazol-3-one

Systemtic Name: 5-tert-butyl-4,4-bis(oxidanyl)-2-(2-phenoxyethyl)pyrazol-3-one Openeye Name: 5-tert-butyl-4,4-dihydroxy-2-(2-phenoxyethyl)pyrazol-3-one CAS Name: 5-tert-butyl-4,4-dihydroxy-2-(2-phenoxyethyl)-3-pyrazolone IUPAC Name: 5-tert-butyl-4,4-dihydroxy-2-(2-phenoxyethyl)pyrazol-3-one Traditional Name: 5-tert-butyl-4,4-dihydroxy-2-(2-phenoxyethyl)-2-pyrazolin-3-one Formula: C15H20N2O4 MolecularWeight: 292.3303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=O)C1(O)O)CCOC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=NN(C(=O)C1(O)O)CCOC2=CC=CC=C2

InChI

InChI=1S/C15H20N2O4/c1-14(2,3)12-15(19,20)13(18)17(16-12)9-10-21-11-7-5-4-6-8-11/h4-8,19-20H,9-10H2,1-3H3