3-[3-(3-acetyloxyprop-1-ynyl)-5,6-dicyano-pyrazin-2-yl]prop-2-ynyl ethanoate

Systemtic Name: 3-[3-(3-acetyloxyprop-1-ynyl)-5,6-dicyano-pyrazin-2-yl]prop-2-ynyl ethanoate Openeye Name: 3-[3-(3-acetoxyprop-1-ynyl)-5,6-dicyano-pyrazin-2-yl]prop-2-ynyl acetate CAS Name: acetic acid 3-[3-(3-acetyloxyprop-1-ynyl)-5,6-dicyano-2-pyrazinyl]prop-2-ynyl ester IUPAC Name: 3-[3-(3-acetyloxyprop-1-ynyl)-5,6-dicyanopyrazin-2-yl]prop-2-ynyl acetate Traditional Name: acetic acid 3-[3-(3-acetoxyprop-1-ynyl)-5,6-dicyano-pyrazin-2-yl]prop-2-ynyl ester Formula: C16H10N4O4 MolecularWeight: 322.275

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC#CC1=C(N=C(C(=N1)C#N)C#N)C#CCOC(=O)C

Isomeric SMILES

CC(=O)OCC#CC1=C(N=C(C(=N1)C#N)C#N)C#CCOC(=O)C

InChI

InChI=1S/C16H10N4O4/c1-11(21)23-7-3-5-13-14(6-4-8-24-12(2)22)20-16(10-18)15(9-17)19-13/h7-8H2,1-2H3