3,6,8-trideuterio-3-(3,5-dideuterio-4-oxidanyl-phenyl)-7-oxidanyl-2H-chromen-4-one

Systemtic Name: 3,6,8-trideuterio-3-(3,5-dideuterio-4-oxidanyl-phenyl)-7-oxidanyl-2H-chromen-4-one Openeye Name: 3,6,8-trideuterio-3-(3,5-dideuterio-4-hydroxy-phenyl)-7-hydroxy-chroman-4-one CAS Name: 3,6,8-trideuterio-3-(3,5-dideuterio-4-hydroxyphenyl)-7-hydroxy-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 3,6,8-trideuterio-3-(3,5-dideuterio-4-hydroxyphenyl)-7-hydroxy-2H-chromen-4-one Traditional Name: 3,6,8-trideuterio-3-(3,5-dideuterio-4-hydroxy-phenyl)-7-hydroxy-chroman-4-one Formula: C15H12O4 MolecularWeight: 261.284189

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)C2=C(O1)C=C(C=C2)O)C3=CC=C(C=C3)O

Isomeric SMILES

[2H]C1=CC(=CC(=C1O)[2H])C2(COC3=C(C2=O)C=C(C(=C3[2H])O)[2H])[2H]

InChI

InChI=1S/C15H12O4/c16-10-3-1-9(2-4-10)13-8-19-14-7-11(17)5-6-12(14)15(13)18/h1-7,13,16-17H,8H2/i3D,4D,5D,7D,13D