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

Systemtic Name: 4-[2-[(2-pyridin-3-yl-3H-benzimidazol-5-yl)carbonyloxy]propanoylamino]benzoic acid Openeye Name: 4-[2-[2-(3-pyridyl)-3H-benzimidazole-5-carbonyl]oxypropanoylamino]benzoic acid CAS Name: 4-[[1-oxo-2-[oxo-[2-(3-pyridinyl)-3H-benzimidazol-5-yl]methoxy]propyl]amino]benzoic acid IUPAC Name: 4-[2-(2-pyridin-3-yl-3H-benzimidazole-5-carbonyl)oxypropanoylamino]benzoic acid Traditional Name: 4-[2-[2-(3-pyridyl)-3H-benzimidazole-5-carbonyl]oxypropanoylamino]benzoic acid Formula: C23H18N4O5 MolecularWeight: 430.41282

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Descriptors Computed from Structure

Canonical SMILES:

CC(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

CC(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/C23H18N4O5/c1-13(21(28)25-17-7-4-14(5-8-17)22(29)30)32-23(31)15-6-9-18-19(11-15)27-20(26-18)16-3-2-10-24-12-16/h2-13H,1H3,(H,25,28)(H,26,27)(H,29,30)