ethyl 5-isocyano-2-methyl-1H-imidazole-4-carboxylate

Systemtic Name: ethyl 5-isocyano-2-methyl-1H-imidazole-4-carboxylate Openeye Name: ethyl 5-isocyano-2-methyl-1H-imidazole-4-carboxylate CAS Name: 5-isocyano-2-methyl-1H-imidazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-isocyano-2-methyl-1H-imidazole-4-carboxylate Traditional Name: 5-isocyano-2-methyl-1H-imidazole-4-carboxylic acid ethyl ester Formula: C8H9N3O2 MolecularWeight: 179.17596

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=N1)C)[N+]#[C-]

Isomeric SMILES

CCOC(=O)C1=C(NC(=N1)C)[N+]#[C-]

InChI

InChI=1S/C8H9N3O2/c1-4-13-8(12)6-7(9-3)11-5(2)10-6/h4H2,1-2H3,(H,10,11)