5-(hydroxymethyl)-2-(2-naphthalen-1-yloxyethyl)-4,4-bis(oxidanyl)pyrazol-3-one

Systemtic Name: 5-(hydroxymethyl)-2-(2-naphthalen-1-yloxyethyl)-4,4-bis(oxidanyl)pyrazol-3-one Openeye Name: 4,4-dihydroxy-5-(hydroxymethyl)-2-[2-(1-naphthyloxy)ethyl]pyrazol-3-one CAS Name: 4,4-dihydroxy-5-(hydroxymethyl)-2-[2-(1-naphthalenyloxy)ethyl]-3-pyrazolone IUPAC Name: 4,4-dihydroxy-5-(hydroxymethyl)-2-(2-naphthalen-1-yloxyethyl)pyrazol-3-one Traditional Name: 4,4-dihydroxy-5-methylol-2-[2-(1-naphthoxy)ethyl]-2-pyrazolin-3-one Formula: C16H16N2O5 MolecularWeight: 316.30864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2OCCN3C(=O)C(C(=N3)CO)(O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2OCCN3C(=O)C(C(=N3)CO)(O)O

InChI

InChI=1S/C16H16N2O5/c19-10-14-16(21,22)15(20)18(17-14)8-9-23-13-7-3-5-11-4-1-2-6-12(11)13/h1-7,19,21-22H,8-10H2