2-(cyanomethylcarbamoyl)-4-ethyl-pyrrole-1-carboxylate

Systemtic Name: 2-(cyanomethylcarbamoyl)-4-ethyl-pyrrole-1-carboxylate Openeye Name: 2-(cyanomethylcarbamoyl)-4-ethyl-pyrrole-1-carboxylate CAS Name: 2-[(cyanomethylamino)-oxomethyl]-4-ethyl-1-pyrrolecarboxylate IUPAC Name: 2-(cyanomethylcarbamoyl)-4-ethylpyrrole-1-carboxylate Traditional Name: 2-(cyanomethylcarbamoyl)-4-ethyl-pyrrole-1-carboxylate Formula: C10H10N3O3- MolecularWeight: 220.2047

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN(C(=C1)C(=O)NCC#N)C(=O)[O-]

Isomeric SMILES

CCC1=CN(C(=C1)C(=O)NCC#N)C(=O)[O-]

InChI

InChI=1S/C10H11N3O3/c1-2-7-5-8(9(14)12-4-3-11)13(6-7)10(15)16/h5-6H,2,4H2,1H3,(H,12,14)(H,15,16)/p-1