4-chloranyl-3-[2-[(2-phenyl-3H-benzimidazol-5-yl)carbonyloxy]butanoylamino]benzoic acid

Systemtic Name: 4-chloranyl-3-[2-[(2-phenyl-3H-benzimidazol-5-yl)carbonyloxy]butanoylamino]benzoic acid Openeye Name: 4-chloro-3-[2-(2-phenyl-3H-benzimidazole-5-carbonyl)oxybutanoylamino]benzoic acid CAS Name: 4-chloro-3-[[1-oxo-2-[oxo-(2-phenyl-3H-benzimidazol-5-yl)methoxy]butyl]amino]benzoic acid IUPAC Name: 4-chloro-3-[2-(2-phenyl-3H-benzimidazole-5-carbonyl)oxybutanoylamino]benzoic acid Traditional Name: 4-chloro-3-[2-(2-phenyl-3H-benzimidazole-5-carbonyl)oxybutanoylamino]benzoic acid Formula: C25H20ClN3O5 MolecularWeight: 477.8964

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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=C(N3)C4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)NC1=C(C=CC(=C1)C(=O)O)Cl)OC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=CC=C4

InChI

InChI=1S/C25H20ClN3O5/c1-2-21(23(30)29-19-12-15(24(31)32)8-10-17(19)26)34-25(33)16-9-11-18-20(13-16)28-22(27-18)14-6-4-3-5-7-14/h3-13,21H,2H2,1H3,(H,27,28)(H,29,30)(H,31,32)