4-[2-(1,3-benzoxazol-5-ylcarbonyloxy)propanoylamino]benzoic acid

Systemtic Name: 4-[2-(1,3-benzoxazol-5-ylcarbonyloxy)propanoylamino]benzoic acid Openeye Name: 4-[2-(1,3-benzoxazole-5-carbonyloxy)propanoylamino]benzoic acid CAS Name: 4-[[2-[1,3-benzoxazol-5-yl(oxo)methoxy]-1-oxopropyl]amino]benzoic acid IUPAC Name: 4-[2-(1,3-benzoxazole-5-carbonyloxy)propanoylamino]benzoic acid Traditional Name: 4-[2-(1,3-benzoxazole-5-carbonyloxy)propanoylamino]benzoic acid Formula: C18H14N2O6 MolecularWeight: 354.31356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)O)OC(=O)C2=CC3=C(C=C2)OC=N3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(=O)O)OC(=O)C2=CC3=C(C=C2)OC=N3

InChI

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