5-chloranyl-6-[6-(6-morpholin-4-yl-1H-benzimidazol-2-yl)pyridin-3-yl]pyridine-3-carboxylic acid

Systemtic Name: 5-chloranyl-6-[6-(6-morpholin-4-yl-1H-benzimidazol-2-yl)pyridin-3-yl]pyridine-3-carboxylic acid Openeye Name: 5-chloro-6-[6-(6-morpholino-1H-benzimidazol-2-yl)-3-pyridyl]pyridine-3-carboxylic acid CAS Name: 5-chloro-6-[6-[6-(4-morpholinyl)-1H-benzimidazol-2-yl]-3-pyridinyl]-3-pyridinecarboxylic acid IUPAC Name: 5-chloro-6-[6-(6-morpholin-4-yl-1H-benzimidazol-2-yl)pyridin-3-yl]pyridine-3-carboxylic acid Traditional Name: 5-chloro-6-[6-(6-morpholino-1H-benzimidazol-2-yl)-3-pyridyl]nicotinic acid Formula: C22H18ClN5O3 MolecularWeight: 435.86302

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC3=C(C=C2)N=C(N3)C4=NC=C(C=C4)C5=C(C=C(C=N5)C(=O)O)Cl

Isomeric SMILES

C1COCCN1C2=CC3=C(C=C2)N=C(N3)C4=NC=C(C=C4)C5=C(C=C(C=N5)C(=O)O)Cl

InChI

InChI=1S/C22H18ClN5O3/c23-16-9-14(22(29)30)12-25-20(16)13-1-3-18(24-11-13)21-26-17-4-2-15(10-19(17)27-21)28-5-7-31-8-6-28/h1-4,9-12H,5-8H2,(H,26,27)(H,29,30)