4-[2-(2-oxidanylidenepyrimidin-1-yl)ethoxy]benzoic acid

Systemtic Name: 4-[2-(2-oxidanylidenepyrimidin-1-yl)ethoxy]benzoic acid Openeye Name: 4-[2-(2-oxopyrimidin-1-yl)ethoxy]benzoic acid CAS Name: 4-[2-(2-oxo-1-pyrimidinyl)ethoxy]benzoic acid IUPAC Name: 4-[2-(2-oxopyrimidin-1-yl)ethoxy]benzoic acid Traditional Name: 4-[2-(2-ketopyrimidin-1-yl)ethoxy]benzoic acid Formula: C13H12N2O4 MolecularWeight: 260.24538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=O)N=C1)CCOC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CN(C(=O)N=C1)CCOC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C13H12N2O4/c16-12(17)10-2-4-11(5-3-10)19-9-8-15-7-1-6-14-13(15)18/h1-7H,8-9H2,(H,16,17)