ethyl 4-(phenylcarbamoyl)-1H-imidazol-3-ium-5-carboxylate

Systemtic Name: ethyl 4-(phenylcarbamoyl)-1H-imidazol-3-ium-5-carboxylate Openeye Name: ethyl 4-(phenylcarbamoyl)-1H-imidazol-3-ium-5-carboxylate CAS Name: 4-[anilino(oxo)methyl]-1H-imidazol-3-ium-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(phenylcarbamoyl)-1H-imidazol-3-ium-5-carboxylate Traditional Name: 4-(phenylcarbamoyl)-1H-imidazol-3-ium-5-carboxylic acid ethyl ester Formula: C13H14N3O3+ MolecularWeight: 260.26856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C([NH+]=CN1)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C([NH+]=CN1)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C13H13N3O3/c1-2-19-13(18)11-10(14-8-15-11)12(17)16-9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,14,15)(H,16,17)/p+1