methyl (2S,4S)-1-ethanoyl-4-(pyrazin-2-ylcarbonylamino)pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4S)-1-ethanoyl-4-(pyrazin-2-ylcarbonylamino)pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4S)-1-acetyl-4-(pyrazine-2-carbonylamino)pyrrolidine-2-carboxylate CAS Name: (2S,4S)-1-acetyl-4-[[oxo(2-pyrazinyl)methyl]amino]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4S)-1-acetyl-4-(pyrazine-2-carbonylamino)pyrrolidine-2-carboxylate Traditional Name: (2S,4S)-1-acetyl-4-(pyrazinoylamino)pyrrolidine-2-carboxylic acid methyl ester Formula: C13H16N4O4 MolecularWeight: 292.29054

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(CC1C(=O)OC)NC(=O)C2=NC=CN=C2

Isomeric SMILES

CC(=O)N1C[C@H](C[C@H]1C(=O)OC)NC(=O)C2=NC=CN=C2

InChI

InChI=1S/C13H16N4O4/c1-8(18)17-7-9(5-11(17)13(20)21-2)16-12(19)10-6-14-3-4-15-10/h3-4,6,9,11H,5,7H2,1-2H3,(H,16,19)/t9-,11-/m0/s1