ethyl 1-[2-(3-cyanophenyl)ethynyl]-3-methyl-pyrrolo[1,2-a]pyrazine-7-carboxylate

Systemtic Name: ethyl 1-[2-(3-cyanophenyl)ethynyl]-3-methyl-pyrrolo[1,2-a]pyrazine-7-carboxylate Openeye Name: ethyl 1-[2-(3-cyanophenyl)ethynyl]-3-methyl-pyrrolo[1,2-a]pyrazine-7-carboxylate CAS Name: 1-[2-(3-cyanophenyl)ethynyl]-3-methyl-7-pyrrolo[1,2-a]pyrazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(3-cyanophenyl)ethynyl]-3-methylpyrrolo[1,2-a]pyrazine-7-carboxylate Traditional Name: 1-[2-(3-cyanophenyl)ethynyl]-3-methyl-pyrrolo[1,2-a]pyrazine-7-carboxylic acid ethyl ester Formula: C20H15N3O2 MolecularWeight: 329.352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN2C=C(N=C(C2=C1)C#CC3=CC(=CC=C3)C#N)C

Isomeric SMILES

CCOC(=O)C1=CN2C=C(N=C(C2=C1)C#CC3=CC(=CC=C3)C#N)C

InChI

InChI=1S/C20H15N3O2/c1-3-25-20(24)17-10-19-18(22-14(2)12-23(19)13-17)8-7-15-5-4-6-16(9-15)11-21/h4-6,9-10,12-13H,3H2,1-2H3