2,4,5-tris(oxidanyl)-1-phenyl-heptan-1-one

Systemtic Name: 2,4,5-tris(oxidanyl)-1-phenyl-heptan-1-one Openeye Name: 2,4,5-trihydroxy-1-phenyl-heptan-1-one CAS Name: 2,4,5-trihydroxy-1-phenyl-1-heptanone IUPAC Name: 2,4,5-trihydroxy-1-phenylheptan-1-one Traditional Name: 2,4,5-trihydroxy-1-phenyl-heptan-1-one Formula: C13H18O4 MolecularWeight: 238.27962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O4/c1-2-10(14)11(15)8-12(16)13(17)9-6-4-3-5-7-9/h3-7,10-12,14-16H,2,8H2,1H3