3-[(6-oxidanylidenepyran-3-yl)carbonylamino]benzoic acid

Systemtic Name: 3-[(6-oxidanylidenepyran-3-yl)carbonylamino]benzoic acid Openeye Name: 3-[(6-oxopyran-3-carbonyl)amino]benzoic acid CAS Name: 3-[[oxo-(6-oxo-3-pyranyl)methyl]amino]benzoic acid IUPAC Name: 3-[(6-oxopyran-3-carbonyl)amino]benzoic acid Traditional Name: 3-[(6-ketopyran-3-carbonyl)amino]benzoic acid Formula: C13H9NO5 MolecularWeight: 259.21426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=COC(=O)C=C2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=COC(=O)C=C2)C(=O)O

InChI

InChI=1S/C13H9NO5/c15-11-5-4-9(7-19-11)12(16)14-10-3-1-2-8(6-10)13(17)18/h1-7H,(H,14,16)(H,17,18)