6-methyl-2,5,6-tris(oxidanyl)-2-phenyl-heptan-3-one

Systemtic Name: 6-methyl-2,5,6-tris(oxidanyl)-2-phenyl-heptan-3-one Openeye Name: 2,5,6-trihydroxy-6-methyl-2-phenyl-heptan-3-one CAS Name: 2,5,6-trihydroxy-6-methyl-2-phenyl-3-heptanone IUPAC Name: 2,5,6-trihydroxy-6-methyl-2-phenylheptan-3-one Traditional Name: 2,5,6-trihydroxy-6-methyl-2-phenyl-heptan-3-one Formula: C14H20O4 MolecularWeight: 252.3062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20O4/c1-13(2,17)11(15)9-12(16)14(3,18)10-7-5-4-6-8-10/h4-8,11,15,17-18H,9H2,1-3H3