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

Systemtic Name: 3-[2-(1,3-benzoxazol-4-ylcarbonyloxy)butanoylamino]-4-chloranyl-benzoic acid Openeye Name: 3-[2-(1,3-benzoxazole-4-carbonyloxy)butanoylamino]-4-chloro-benzoic acid CAS Name: 3-[[2-[1,3-benzoxazol-4-yl(oxo)methoxy]-1-oxobutyl]amino]-4-chlorobenzoic acid IUPAC Name: 3-[2-(1,3-benzoxazole-4-carbonyloxy)butanoylamino]-4-chlorobenzoic acid Traditional Name: 3-[2-(1,3-benzoxazole-4-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=C3C(=CC=C2)OC=N3

Isomeric SMILES

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

InChI

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