1-(2-acetamidoethyl)benzimidazole-5-carboxylic acid

Systemtic Name: 1-(2-acetamidoethyl)benzimidazole-5-carboxylic acid Openeye Name: 1-(2-acetamidoethyl)benzimidazole-5-carboxylic acid CAS Name: 1-(2-acetamidoethyl)-5-benzimidazolecarboxylic acid IUPAC Name: 1-(2-acetamidoethyl)benzimidazole-5-carboxylic acid Traditional Name: 1-(2-acetamidoethyl)benzimidazole-5-carboxylic acid Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCN1C=NC2=C1C=CC(=C2)C(=O)O

Isomeric SMILES

CC(=O)NCCN1C=NC2=C1C=CC(=C2)C(=O)O

InChI

InChI=1S/C12H13N3O3/c1-8(16)13-4-5-15-7-14-10-6-9(12(17)18)2-3-11(10)15/h2-3,6-7H,4-5H2,1H3,(H,13,16)(H,17,18)