1-[2-(dimethylazaniumyl)ethyl]benzimidazole-5-carboxylate

Systemtic Name: 1-[2-(dimethylazaniumyl)ethyl]benzimidazole-5-carboxylate Openeye Name: 1-[2-(dimethylammonio)ethyl]benzimidazole-5-carboxylate CAS Name: 1-[2-(dimethylammonio)ethyl]-5-benzimidazolecarboxylate IUPAC Name: 1-[2-(dimethylazaniumyl)ethyl]benzimidazole-5-carboxylate Traditional Name: 1-[2-(dimethylammonio)ethyl]benzimidazole-5-carboxylate Formula: C12H15N3O2 MolecularWeight: 233.2664

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1C=NC2=C1C=CC(=C2)C(=O)[O-]

Isomeric SMILES

C[NH+](C)CCN1C=NC2=C1C=CC(=C2)C(=O)[O-]

InChI

InChI=1S/C12H15N3O2/c1-14(2)5-6-15-8-13-10-7-9(12(16)17)3-4-11(10)15/h3-4,7-8H,5-6H2,1-2H3,(H,16,17)