2-(hydroxymethyl)-4-methyl-2,3-bis(oxidanyl)-1-phenyl-pent-3-en-1-one

Systemtic Name: 2-(hydroxymethyl)-4-methyl-2,3-bis(oxidanyl)-1-phenyl-pent-3-en-1-one Openeye Name: 2,3-dihydroxy-2-(hydroxymethyl)-4-methyl-1-phenyl-pent-3-en-1-one CAS Name: 2,3-dihydroxy-2-(hydroxymethyl)-4-methyl-1-phenyl-3-penten-1-one IUPAC Name: 2,3-dihydroxy-2-(hydroxymethyl)-4-methyl-1-phenylpent-3-en-1-one Traditional Name: 2,3-dihydroxy-4-methyl-2-methylol-1-phenyl-pent-3-en-1-one Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(CO)(C(=O)C1=CC=CC=C1)O)O)C

Isomeric SMILES

CC(=C(C(CO)(C(=O)C1=CC=CC=C1)O)O)C

InChI

InChI=1S/C13H16O4/c1-9(2)11(15)13(17,8-14)12(16)10-6-4-3-5-7-10/h3-7,14-15,17H,8H2,1-2H3