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

Systemtic Name: 2-chloranyl-5-[2-[(2-pyridin-3-yl-3H-benzimidazol-5-yl)carbonyloxy]propanoylamino]benzoic acid Openeye Name: 2-chloro-5-[2-[2-(3-pyridyl)-3H-benzimidazole-5-carbonyl]oxypropanoylamino]benzoic acid CAS Name: 2-chloro-5-[[1-oxo-2-[oxo-[2-(3-pyridinyl)-3H-benzimidazol-5-yl]methoxy]propyl]amino]benzoic acid IUPAC Name: 2-chloro-5-[2-(2-pyridin-3-yl-3H-benzimidazole-5-carbonyl)oxypropanoylamino]benzoic acid Traditional Name: 2-chloro-5-[2-[2-(3-pyridyl)-3H-benzimidazole-5-carbonyl]oxypropanoylamino]benzoic acid Formula: C23H17ClN4O5 MolecularWeight: 464.85788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C23H17ClN4O5/c1-12(21(29)26-15-5-6-17(24)16(10-15)22(30)31)33-23(32)13-4-7-18-19(9-13)28-20(27-18)14-3-2-8-25-11-14/h2-12H,1H3,(H,26,29)(H,27,28)(H,30,31)