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

Systemtic Name: 4-[(1,2-oxazol-5-ylcarbonylamino)methyl]benzoic acid Openeye Name: 4-[(isoxazole-5-carbonylamino)methyl]benzoic acid CAS Name: 4-[[[5-isoxazolyl(oxo)methyl]amino]methyl]benzoic acid IUPAC Name: 4-[(1,2-oxazole-5-carbonylamino)methyl]benzoic acid Traditional Name: 4-[(isoxazole-5-carbonylamino)methyl]benzoic acid Formula: C12H10N2O4 MolecularWeight: 246.2188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CC=NO2)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CC=NO2)C(=O)O

InChI

InChI=1S/C12H10N2O4/c15-11(10-5-6-14-18-10)13-7-8-1-3-9(4-2-8)12(16)17/h1-6H,7H2,(H,13,15)(H,16,17)