4-[(E)-2-[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]ethenyl]benzoic acid

Systemtic Name: 4-[(E)-2-[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]ethenyl]benzoic acid Openeye Name: 4-[(E)-2-(2,4-dioxo-1H-pyrimidin-5-yl)vinyl]benzoic acid CAS Name: 4-[(E)-2-(2,4-dioxo-1H-pyrimidin-5-yl)ethenyl]benzoic acid IUPAC Name: 4-[(E)-2-(2,4-dioxo-1H-pyrimidin-5-yl)ethenyl]benzoic acid Traditional Name: 4-[(E)-2-(2,4-diketo-1H-pyrimidin-5-yl)vinyl]benzoic acid Formula: C13H10N2O4 MolecularWeight: 258.2295

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC2=CNC(=O)NC2=O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1/C=C/C2=CNC(=O)NC2=O)C(=O)O

InChI

InChI=1S/C13H10N2O4/c16-11-10(7-14-13(19)15-11)6-3-8-1-4-9(5-2-8)12(17)18/h1-7H,(H,17,18)(H2,14,15,16,19)/b6-3+