6-chloranyl-4-(propanoylamino)-1H-benzimidazole-2-carboxylic acid

Systemtic Name: 6-chloranyl-4-(propanoylamino)-1H-benzimidazole-2-carboxylic acid Openeye Name: 6-chloro-4-(propanoylamino)-1H-benzimidazole-2-carboxylic acid CAS Name: 6-chloro-4-(1-oxopropylamino)-1H-benzimidazole-2-carboxylic acid IUPAC Name: 6-chloro-4-(propanoylamino)-1H-benzimidazole-2-carboxylic acid Traditional Name: 6-chloro-4-propionamido-1H-benzimidazole-2-carboxylic acid Formula: C11H10ClN3O3 MolecularWeight: 267.6684

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C2C(=CC(=C1)Cl)NC(=N2)C(=O)O

Isomeric SMILES

CCC(=O)NC1=C2C(=CC(=C1)Cl)NC(=N2)C(=O)O

InChI

InChI=1S/C11H10ClN3O3/c1-2-8(16)13-6-3-5(12)4-7-9(6)15-10(14-7)11(17)18/h3-4H,2H2,1H3,(H,13,16)(H,14,15)(H,17,18)