[2-oxidanylidene-2-[[(2R)-1-oxidanylidene-1-(propylamino)propan-2-yl]amino]ethyl] pyrazine-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[(2R)-1-oxidanylidene-1-(propylamino)propan-2-yl]amino]ethyl] pyrazine-2-carboxylate Openeye Name: [2-[[(1R)-1-methyl-2-oxo-2-(propylamino)ethyl]amino]-2-oxo-ethyl] pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [2-oxo-2-[[(2R)-1-oxo-1-(propylamino)propan-2-yl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2R)-1-oxo-1-(propylamino)propan-2-yl]amino]ethyl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid [2-keto-2-[[(1R)-2-keto-1-methyl-2-(propylamino)ethyl]amino]ethyl] ester Formula: C13H18N4O4 MolecularWeight: 294.30642

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)COC(=O)C1=NC=CN=C1

Isomeric SMILES

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

InChI

InChI=1S/C13H18N4O4/c1-3-4-16-12(19)9(2)17-11(18)8-21-13(20)10-7-14-5-6-15-10/h5-7,9H,3-4,8H2,1-2H3,(H,16,19)(H,17,18)/t9-/m1/s1