5-[2-(3H-benzimidazol-5-ylcarbonyloxy)propanoylamino]-2-chloranyl-benzoic acid

Systemtic Name: 5-[2-(3H-benzimidazol-5-ylcarbonyloxy)propanoylamino]-2-chloranyl-benzoic acid Openeye Name: 5-[2-(3H-benzimidazole-5-carbonyloxy)propanoylamino]-2-chloro-benzoic acid CAS Name: 5-[[2-[3H-benzimidazol-5-yl(oxo)methoxy]-1-oxopropyl]amino]-2-chlorobenzoic acid IUPAC Name: 5-[2-(3H-benzimidazole-5-carbonyloxy)propanoylamino]-2-chlorobenzoic acid Traditional Name: 5-[2-(3H-benzimidazole-5-carbonyloxy)propanoylamino]-2-chloro-benzoic acid Formula: C18H14ClN3O5 MolecularWeight: 387.77386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)Cl)C(=O)O)OC(=O)C2=CC3=C(C=C2)N=CN3

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1)Cl)C(=O)O)OC(=O)C2=CC3=C(C=C2)N=CN3

InChI

InChI=1S/C18H14ClN3O5/c1-9(16(23)22-11-3-4-13(19)12(7-11)17(24)25)27-18(26)10-2-5-14-15(6-10)21-8-20-14/h2-9H,1H3,(H,20,21)(H,22,23)(H,24,25)