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

Systemtic Name: 2-chloranyl-5-[2-[(2-phenyl-3H-benzimidazol-5-yl)carbonyloxy]butanoylamino]benzoic acid Openeye Name: 2-chloro-5-[2-(2-phenyl-3H-benzimidazole-5-carbonyl)oxybutanoylamino]benzoic acid CAS Name: 2-chloro-5-[[1-oxo-2-[oxo-(2-phenyl-3H-benzimidazol-5-yl)methoxy]butyl]amino]benzoic acid IUPAC Name: 2-chloro-5-[2-(2-phenyl-3H-benzimidazole-5-carbonyl)oxybutanoylamino]benzoic acid Traditional Name: 2-chloro-5-[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=CC(=C(C=C1)Cl)C(=O)O)OC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=CC=C4

Isomeric SMILES

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

InChI

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