3-[2-[2,4-bis(oxidanylidene)pyrimidin-1-yl]ethanoylamino]benzoic acid

Systemtic Name: 3-[2-[2,4-bis(oxidanylidene)pyrimidin-1-yl]ethanoylamino]benzoic acid Openeye Name: 3-[[2-(2,4-dioxopyrimidin-1-yl)acetyl]amino]benzoic acid CAS Name: 3-[[2-(2,4-dioxo-1-pyrimidinyl)-1-oxoethyl]amino]benzoic acid IUPAC Name: 3-[[2-(2,4-dioxopyrimidin-1-yl)acetyl]amino]benzoic acid Traditional Name: 3-[[2-(2,4-diketopyrimidin-1-yl)acetyl]amino]benzoic acid Formula: C13H11N3O5 MolecularWeight: 289.24354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11N3O5/c17-10-4-5-16(13(21)15-10)7-11(18)14-9-3-1-2-8(6-9)12(19)20/h1-6H,7H2,(H,14,18)(H,19,20)(H,15,17,21)