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

Systemtic Name: 4-[2-[(2-pyridin-3-yl-3H-benzimidazol-5-yl)carbonyloxy]butanoylamino]benzoic acid Openeye Name: 4-[2-[2-(3-pyridyl)-3H-benzimidazole-5-carbonyl]oxybutanoylamino]benzoic acid CAS Name: 4-[[1-oxo-2-[oxo-[2-(3-pyridinyl)-3H-benzimidazol-5-yl]methoxy]butyl]amino]benzoic acid IUPAC Name: 4-[2-(2-pyridin-3-yl-3H-benzimidazole-5-carbonyl)oxybutanoylamino]benzoic acid Traditional Name: 4-[2-[2-(3-pyridyl)-3H-benzimidazole-5-carbonyl]oxybutanoylamino]benzoic acid Formula: C24H20N4O5 MolecularWeight: 444.4394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H20N4O5/c1-2-20(22(29)26-17-8-5-14(6-9-17)23(30)31)33-24(32)15-7-10-18-19(12-15)28-21(27-18)16-4-3-11-25-13-16/h3-13,20H,2H2,1H3,(H,26,29)(H,27,28)(H,30,31)