1-[2-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)ethyl]-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-[2-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)ethyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-[2-(3-methyl-2-oxo-benzimidazol-1-yl)ethyl]triazole-4-carboxylic acid CAS Name: 1-[2-(3-methyl-2-oxo-1-benzimidazolyl)ethyl]-4-triazolecarboxylic acid IUPAC Name: 1-[2-(3-methyl-2-oxobenzimidazol-1-yl)ethyl]triazole-4-carboxylic acid Traditional Name: 1-[2-(2-keto-3-methyl-benzimidazol-1-yl)ethyl]triazole-4-carboxylic acid Formula: C13H13N5O3 MolecularWeight: 287.27402

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=O)CCN3C=C(N=N3)C(=O)O

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=O)CCN3C=C(N=N3)C(=O)O

InChI

InChI=1S/C13H13N5O3/c1-16-10-4-2-3-5-11(10)18(13(16)21)7-6-17-8-9(12(19)20)14-15-17/h2-5,8H,6-7H2,1H3,(H,19,20)