O2-(1-cyanoethyl) O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-(1-cyanoethyl) O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-(1-cyanoethyl) O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-(1-cyanoethyl) ester O4-ethyl ester IUPAC Name: 2-O-(1-cyanoethyl) 4-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-(1-cyanoethyl) ester O4-ethyl ester Formula: C13H16N2O4 MolecularWeight: 264.27714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OC(C)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OC(C)C#N)C

InChI

InChI=1S/C13H16N2O4/c1-5-18-12(16)10-8(3)11(15-9(10)4)13(17)19-7(2)6-14/h7,15H,5H2,1-4H3