3-[2-(1,3-benzoxazol-4-ylcarbonyloxy)propanoylamino]benzoic acid

Systemtic Name: 3-[2-(1,3-benzoxazol-4-ylcarbonyloxy)propanoylamino]benzoic acid Openeye Name: 3-[2-(1,3-benzoxazole-4-carbonyloxy)propanoylamino]benzoic acid CAS Name: 3-[[2-[1,3-benzoxazol-4-yl(oxo)methoxy]-1-oxopropyl]amino]benzoic acid IUPAC Name: 3-[2-(1,3-benzoxazole-4-carbonyloxy)propanoylamino]benzoic acid Traditional Name: 3-[2-(1,3-benzoxazole-4-carbonyloxy)propanoylamino]benzoic acid Formula: C18H14N2O6 MolecularWeight: 354.31356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C(=O)O)OC(=O)C2=C3C(=CC=C2)OC=N3

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)C(=O)O)OC(=O)C2=C3C(=CC=C2)OC=N3

InChI

InChI=1S/C18H14N2O6/c1-10(16(21)20-12-5-2-4-11(8-12)17(22)23)26-18(24)13-6-3-7-14-15(13)19-9-25-14/h2-10H,1H3,(H,20,21)(H,22,23)