ethyl 4-[(2-methylphenyl)carbamoyl]-1H-imidazol-3-ium-5-carboxylate

Systemtic Name: ethyl 4-[(2-methylphenyl)carbamoyl]-1H-imidazol-3-ium-5-carboxylate Openeye Name: ethyl 4-(o-tolylcarbamoyl)-1H-imidazol-3-ium-5-carboxylate CAS Name: 4-[(2-methylanilino)-oxomethyl]-1H-imidazol-3-ium-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2-methylphenyl)carbamoyl]-1H-imidazol-3-ium-5-carboxylate Traditional Name: 4-(o-tolylcarbamoyl)-1H-imidazol-3-ium-5-carboxylic acid ethyl ester Formula: C14H16N3O3+ MolecularWeight: 274.29514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C([NH+]=CN1)C(=O)NC2=CC=CC=C2C

Isomeric SMILES

CCOC(=O)C1=C([NH+]=CN1)C(=O)NC2=CC=CC=C2C

InChI

InChI=1S/C14H15N3O3/c1-3-20-14(19)12-11(15-8-16-12)13(18)17-10-7-5-4-6-9(10)2/h4-8H,3H2,1-2H3,(H,15,16)(H,17,18)/p+1