[(3R)-4-azanyl-3-cyano-2-oxidanylidene-pent-4-enyl] pyrazine-2-carboxylate

Systemtic Name: [(3R)-4-azanyl-3-cyano-2-oxidanylidene-pent-4-enyl] pyrazine-2-carboxylate Openeye Name: [(3R)-4-amino-3-cyano-2-oxo-pent-4-enyl] pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [(3R)-4-amino-3-cyano-2-oxopent-4-enyl] ester IUPAC Name: [(3R)-4-amino-3-cyano-2-oxopent-4-enyl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid [(3R)-4-amino-3-cyano-2-keto-pent-4-enyl] ester Formula: C11H10N4O3 MolecularWeight: 246.2221

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(C#N)C(=O)COC(=O)C1=NC=CN=C1)N

Isomeric SMILES

C=C([C@H](C#N)C(=O)COC(=O)C1=NC=CN=C1)N

InChI

InChI=1S/C11H10N4O3/c1-7(13)8(4-12)10(16)6-18-11(17)9-5-14-2-3-15-9/h2-3,5,8H,1,6,13H2/t8-/m0/s1