(2R)-4-(1,2-oxazol-5-ylcarbonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylate

Systemtic Name: (2R)-4-(1,2-oxazol-5-ylcarbonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylate Openeye Name: (2R)-4-(isoxazole-5-carbonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylate CAS Name: (2R)-4-[5-isoxazolyl(oxo)methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxylate IUPAC Name: (2R)-4-(1,2-oxazole-5-carbonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylate Traditional Name: (2R)-4-(isoxazole-5-carbonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylate Formula: C13H9N2O5- MolecularWeight: 273.22096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2N1C(=O)C3=CC=NO3)C(=O)[O-]

Isomeric SMILES

C1[C@@H](OC2=CC=CC=C2N1C(=O)C3=CC=NO3)C(=O)[O-]

InChI

InChI=1S/C13H10N2O5/c16-12(10-5-6-14-20-10)15-7-11(13(17)18)19-9-4-2-1-3-8(9)15/h1-6,11H,7H2,(H,17,18)/p-1/t11-/m1/s1