4-[2-(1,2-oxazol-5-ylcarbonylamino)ethyl]benzoic acid

Systemtic Name: 4-[2-(1,2-oxazol-5-ylcarbonylamino)ethyl]benzoic acid Openeye Name: 4-[2-(isoxazole-5-carbonylamino)ethyl]benzoic acid CAS Name: 4-[2-[[5-isoxazolyl(oxo)methyl]amino]ethyl]benzoic acid IUPAC Name: 4-[2-(1,2-oxazole-5-carbonylamino)ethyl]benzoic acid Traditional Name: 4-[2-(isoxazole-5-carbonylamino)ethyl]benzoic acid Formula: C13H12N2O4 MolecularWeight: 260.24538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=O)C2=CC=NO2)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CCNC(=O)C2=CC=NO2)C(=O)O

InChI

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