ethyl 5-(2-cyanoethanoyl)-2-methyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-(2-cyanoethanoyl)-2-methyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-(2-cyanoacetyl)-2-methyl-1H-pyrrole-3-carboxylate CAS Name: 5-(2-cyano-1-oxoethyl)-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-cyanoacetyl)-2-methyl-1H-pyrrole-3-carboxylate Traditional Name: 5-(2-cyanoacetyl)-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C11H12N2O3 MolecularWeight: 220.22458

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1)C(=O)CC#N)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1)C(=O)CC#N)C

InChI

InChI=1S/C11H12N2O3/c1-3-16-11(15)8-6-9(13-7(8)2)10(14)4-5-12/h6,13H,3-4H2,1-2H3