3-(4-chlorophenyl)-2-[(2-pyridin-4-yl-3H-benzimidazol-5-yl)carbonylamino]propanoic acid

Systemtic Name: 3-(4-chlorophenyl)-2-[(2-pyridin-4-yl-3H-benzimidazol-5-yl)carbonylamino]propanoic acid Openeye Name: 3-(4-chlorophenyl)-2-[[2-(4-pyridyl)-3H-benzimidazole-5-carbonyl]amino]propanoic acid CAS Name: 3-(4-chlorophenyl)-2-[[oxo-(2-pyridin-4-yl-3H-benzimidazol-5-yl)methyl]amino]propanoic acid IUPAC Name: 3-(4-chlorophenyl)-2-[(2-pyridin-4-yl-3H-benzimidazole-5-carbonyl)amino]propanoic acid Traditional Name: 3-(4-chlorophenyl)-2-[[2-(4-pyridyl)-3H-benzimidazole-5-carbonyl]amino]propionic acid Formula: C22H17ClN4O3 MolecularWeight: 420.84838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)NC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=NC=C4)Cl

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)O)NC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=NC=C4)Cl

InChI

InChI=1S/C22H17ClN4O3/c23-16-4-1-13(2-5-16)11-19(22(29)30)27-21(28)15-3-6-17-18(12-15)26-20(25-17)14-7-9-24-10-8-14/h1-10,12,19H,11H2,(H,25,26)(H,27,28)(H,29,30)