diethyl 6-cyano-2-ethoxy-pyrrolo[1,2-a]pyrimidine-7,8-dicarboxylate

Systemtic Name: diethyl 6-cyano-2-ethoxy-pyrrolo[1,2-a]pyrimidine-7,8-dicarboxylate Openeye Name: diethyl 6-cyano-2-ethoxy-pyrrolo[1,2-a]pyrimidine-7,8-dicarboxylate CAS Name: 6-cyano-2-ethoxypyrrolo[1,2-a]pyrimidine-7,8-dicarboxylic acid diethyl ester IUPAC Name: diethyl 6-cyano-2-ethoxypyrrolo[1,2-a]pyrimidine-7,8-dicarboxylate Traditional Name: 6-cyano-2-ethoxy-pyrrolo[1,2-a]pyrimidine-7,8-dicarboxylic acid diethyl ester Formula: C16H17N3O5 MolecularWeight: 331.32328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2=C(C(=C(N2C=C1)C#N)C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCOC1=NC2=C(C(=C(N2C=C1)C#N)C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C16H17N3O5/c1-4-22-11-7-8-19-10(9-17)12(15(20)23-5-2)13(14(19)18-11)16(21)24-6-3/h7-8H,4-6H2,1-3H3