ethyl 8-cyano-3-ethanoyl-4,6,7-trimethyl-1H-pyrrolo[1,2-a]pyrimidine-4-carboxylate

Systemtic Name: ethyl 8-cyano-3-ethanoyl-4,6,7-trimethyl-1H-pyrrolo[1,2-a]pyrimidine-4-carboxylate Openeye Name: ethyl 3-acetyl-8-cyano-4,6,7-trimethyl-1H-pyrrolo[1,2-a]pyrimidine-4-carboxylate CAS Name: 3-acetyl-8-cyano-4,6,7-trimethyl-1H-pyrrolo[1,2-a]pyrimidine-4-carboxylic acid ethyl ester IUPAC Name: ethyl 3-acetyl-8-cyano-4,6,7-trimethyl-1H-pyrrolo[1,2-a]pyrimidine-4-carboxylate Traditional Name: 3-acetyl-8-cyano-4,6,7-trimethyl-1H-pyrrolo[1,2-a]pyrimidine-4-carboxylic acid ethyl ester Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(=CNC2=C(C(=C(N21)C)C)C#N)C(=O)C)C

Isomeric SMILES

CCOC(=O)C1(C(=CNC2=C(C(=C(N21)C)C)C#N)C(=O)C)C

InChI

InChI=1S/C16H19N3O3/c1-6-22-15(21)16(5)13(11(4)20)8-18-14-12(7-17)9(2)10(3)19(14)16/h8,18H,6H2,1-5H3