3-[2-(1,3-benzoxazol-6-ylcarbonyloxy)butanoylamino]-4-chloranyl-benzoic acid

Systemtic Name: 3-[2-(1,3-benzoxazol-6-ylcarbonyloxy)butanoylamino]-4-chloranyl-benzoic acid Openeye Name: 3-[2-(1,3-benzoxazole-6-carbonyloxy)butanoylamino]-4-chloro-benzoic acid CAS Name: 3-[[2-[1,3-benzoxazol-6-yl(oxo)methoxy]-1-oxobutyl]amino]-4-chlorobenzoic acid IUPAC Name: 3-[2-(1,3-benzoxazole-6-carbonyloxy)butanoylamino]-4-chlorobenzoic acid Traditional Name: 3-[2-(1,3-benzoxazole-6-carbonyloxy)butanoylamino]-4-chloro-benzoic acid Formula: C19H15ClN2O6 MolecularWeight: 402.7852

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=CC(=C1)C(=O)O)Cl)OC(=O)C2=CC3=C(C=C2)N=CO3

Isomeric SMILES

CCC(C(=O)NC1=C(C=CC(=C1)C(=O)O)Cl)OC(=O)C2=CC3=C(C=C2)N=CO3

InChI

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