5-[(2R)-2-acetamido-3-oxidanyl-3-oxidanylidene-propyl]-2-methoxy-benzoic acid

Systemtic Name: 5-[(2R)-2-acetamido-3-oxidanyl-3-oxidanylidene-propyl]-2-methoxy-benzoic acid Openeye Name: 5-[(2R)-2-acetamido-3-hydroxy-3-oxo-propyl]-2-methoxy-benzoic acid CAS Name: 5-[(2R)-2-acetamido-3-hydroxy-3-oxopropyl]-2-methoxybenzoic acid IUPAC Name: 5-[(2R)-2-acetamido-3-hydroxy-3-oxopropyl]-2-methoxybenzoic acid Traditional Name: 5-[(2R)-2-acetamido-3-hydroxy-3-keto-propyl]-2-methoxy-benzoic acid Formula: C13H15NO6 MolecularWeight: 281.2613

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC(=C(C=C1)OC)C(=O)O)C(=O)O

Isomeric SMILES

CC(=O)N[C@H](CC1=CC(=C(C=C1)OC)C(=O)O)C(=O)O

InChI

InChI=1S/C13H15NO6/c1-7(15)14-10(13(18)19)6-8-3-4-11(20-2)9(5-8)12(16)17/h3-5,10H,6H2,1-2H3,(H,14,15)(H,16,17)(H,18,19)/t10-/m1/s1