2-oxidanyl-5-(2,2,3,3,3-pentadeuteriopropanoylamino)benzoic acid

Systemtic Name: 2-oxidanyl-5-(2,2,3,3,3-pentadeuteriopropanoylamino)benzoic acid Openeye Name: 2-hydroxy-5-(2,2,3,3,3-pentadeuteriopropanoylamino)benzoic acid CAS Name: 2-hydroxy-5-[(2,2,3,3,3-pentadeuterio-1-oxopropyl)amino]benzoic acid IUPAC Name: 2-hydroxy-5-(2,2,3,3,3-pentadeuteriopropanoylamino)benzoic acid Traditional Name: 2-hydroxy-5-(2,2,3,3,3-pentadeuteriopropanoylamino)benzoic acid Formula: C10H11NO4 MolecularWeight: 214.229449

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)O)C(=O)O

Isomeric SMILES

[2H]C([2H])([2H])C([2H])([2H])C(=O)NC1=CC(=C(C=C1)O)C(=O)O

InChI

InChI=1S/C10H11NO4/c1-2-9(13)11-6-3-4-8(12)7(5-6)10(14)15/h3-5,12H,2H2,1H3,(H,11,13)(H,14,15)/i1D3,2D2