5-[(5-chloranylpyridin-2-yl)carbamoyl]-1-methyl-4-(3-oxidanylazetidin-1-yl)carbonyl-benzimidazole-2-carboxylic acid

Systemtic Name: 5-[(5-chloranylpyridin-2-yl)carbamoyl]-1-methyl-4-(3-oxidanylazetidin-1-yl)carbonyl-benzimidazole-2-carboxylic acid Openeye Name: 5-[(5-chloro-2-pyridyl)carbamoyl]-4-(3-hydroxyazetidine-1-carbonyl)-1-methyl-benzimidazole-2-carboxylic acid CAS Name: 5-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]-4-[(3-hydroxy-1-azetidinyl)-oxomethyl]-1-methyl-2-benzimidazolecarboxylic acid IUPAC Name: 5-[(5-chloropyridin-2-yl)carbamoyl]-4-(3-hydroxyazetidine-1-carbonyl)-1-methylbenzimidazole-2-carboxylic acid Traditional Name: 5-[(5-chloro-2-pyridyl)carbamoyl]-4-(3-hydroxyazetidine-1-carbonyl)-1-methyl-benzimidazole-2-carboxylic acid Formula: C19H16ClN5O5 MolecularWeight: 429.81384

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=C(C=C2)C(=O)NC3=NC=C(C=C3)Cl)C(=O)N4CC(C4)O)N=C1C(=O)O

Isomeric SMILES

CN1C2=C(C(=C(C=C2)C(=O)NC3=NC=C(C=C3)Cl)C(=O)N4CC(C4)O)N=C1C(=O)O

InChI

InChI=1S/C19H16ClN5O5/c1-24-12-4-3-11(17(27)22-13-5-2-9(20)6-21-13)14(15(12)23-16(24)19(29)30)18(28)25-7-10(26)8-25/h2-6,10,26H,7-8H2,1H3,(H,29,30)(H,21,22,27)