3-[2-(2-oxidanylidenepyrimidin-1-yl)ethanoylamino]benzoic acid

Systemtic Name: 3-[2-(2-oxidanylidenepyrimidin-1-yl)ethanoylamino]benzoic acid Openeye Name: 3-[[2-(2-oxopyrimidin-1-yl)acetyl]amino]benzoic acid CAS Name: 3-[[1-oxo-2-(2-oxo-1-pyrimidinyl)ethyl]amino]benzoic acid IUPAC Name: 3-[[2-(2-oxopyrimidin-1-yl)acetyl]amino]benzoic acid Traditional Name: 3-[[2-(2-ketopyrimidin-1-yl)acetyl]amino]benzoic acid Formula: C13H11N3O4 MolecularWeight: 273.24414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CN2C=CC=NC2=O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CN2C=CC=NC2=O)C(=O)O

InChI

InChI=1S/C13H11N3O4/c17-11(8-16-6-2-5-14-13(16)20)15-10-4-1-3-9(7-10)12(18)19/h1-7H,8H2,(H,15,17)(H,18,19)