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

Systemtic Name: 5-(3-methoxyphenyl)-4,4-bis(oxidanyl)-2-(phenylmethyl)pyrazol-3-one Openeye Name: 2-benzyl-4,4-dihydroxy-5-(3-methoxyphenyl)pyrazol-3-one CAS Name: 4,4-dihydroxy-5-(3-methoxyphenyl)-2-(phenylmethyl)-3-pyrazolone IUPAC Name: 2-benzyl-4,4-dihydroxy-5-(3-methoxyphenyl)pyrazol-3-one Traditional Name: 2-benzyl-4,4-dihydroxy-5-(3-methoxyphenyl)-2-pyrazolin-3-one Formula: C17H16N2O4 MolecularWeight: 312.31994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(C(=O)C2(O)O)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(C(=O)C2(O)O)CC3=CC=CC=C3

InChI

InChI=1S/C17H16N2O4/c1-23-14-9-5-8-13(10-14)15-17(21,22)16(20)19(18-15)11-12-6-3-2-4-7-12/h2-10,21-22H,11H2,1H3