5-[2-(1,3-benzoxazol-5-ylcarbonyloxy)butanoylamino]-2-chloranyl-benzoic acid

Systemtic Name: 5-[2-(1,3-benzoxazol-5-ylcarbonyloxy)butanoylamino]-2-chloranyl-benzoic acid Openeye Name: 5-[2-(1,3-benzoxazole-5-carbonyloxy)butanoylamino]-2-chloro-benzoic acid CAS Name: 5-[[2-[1,3-benzoxazol-5-yl(oxo)methoxy]-1-oxobutyl]amino]-2-chlorobenzoic acid IUPAC Name: 5-[2-(1,3-benzoxazole-5-carbonyloxy)butanoylamino]-2-chlorobenzoic acid Traditional Name: 5-[2-(1,3-benzoxazole-5-carbonyloxy)butanoylamino]-2-chloro-benzoic acid Formula: C19H15ClN2O6 MolecularWeight: 402.7852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15ClN2O6/c1-2-15(17(23)22-11-4-5-13(20)12(8-11)18(24)25)28-19(26)10-3-6-16-14(7-10)21-9-27-16/h3-9,15H,2H2,1H3,(H,22,23)(H,24,25)