3-[2-(3H-benzimidazol-5-ylcarbonyloxy)butanoylamino]-4-chloranyl-benzoic acid

Systemtic Name: 3-[2-(3H-benzimidazol-5-ylcarbonyloxy)butanoylamino]-4-chloranyl-benzoic acid Openeye Name: 3-[2-(3H-benzimidazole-5-carbonyloxy)butanoylamino]-4-chloro-benzoic acid CAS Name: 3-[[2-[3H-benzimidazol-5-yl(oxo)methoxy]-1-oxobutyl]amino]-4-chlorobenzoic acid IUPAC Name: 3-[2-(3H-benzimidazole-5-carbonyloxy)butanoylamino]-4-chlorobenzoic acid Traditional Name: 3-[2-(3H-benzimidazole-5-carbonyloxy)butanoylamino]-4-chloro-benzoic acid Formula: C19H16ClN3O5 MolecularWeight: 401.80044

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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=CN3

Isomeric SMILES

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

InChI

InChI=1S/C19H16ClN3O5/c1-2-16(17(24)23-14-7-10(18(25)26)3-5-12(14)20)28-19(27)11-4-6-13-15(8-11)22-9-21-13/h3-9,16H,2H2,1H3,(H,21,22)(H,23,24)(H,25,26)