2,3-dideuterio-3-(3-methoxy-4-oxidanyl-phenyl)propanoic acid

Systemtic Name: 2,3-dideuterio-3-(3-methoxy-4-oxidanyl-phenyl)propanoic acid Openeye Name: 2,3-dideuterio-3-(4-hydroxy-3-methoxy-phenyl)propanoic acid CAS Name: 2,3-dideuterio-3-(4-hydroxy-3-methoxyphenyl)propanoic acid IUPAC Name: 2,3-dideuterio-3-(4-hydroxy-3-methoxyphenyl)propanoic acid Traditional Name: 2,3-dideuterio-3-(4-hydroxy-3-methoxy-phenyl)propionic acid Formula: C10H12O4 MolecularWeight: 198.212204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCC(=O)O)O

Isomeric SMILES

[2H]C(C1=CC(=C(C=C1)O)OC)C([2H])C(=O)O

InChI

InChI=1S/C10H12O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2,4,6,11H,3,5H2,1H3,(H,12,13)/i3D,5D