[2-oxidanylidene-2-[[(1R)-1-phenylbutyl]amino]ethyl] 3-azanylpyrazine-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[(1R)-1-phenylbutyl]amino]ethyl] 3-azanylpyrazine-2-carboxylate Openeye Name: [2-oxo-2-[[(1R)-1-phenylbutyl]amino]ethyl] 3-aminopyrazine-2-carboxylate CAS Name: 3-amino-2-pyrazinecarboxylic acid [2-oxo-2-[[(1R)-1-phenylbutyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(1R)-1-phenylbutyl]amino]ethyl] 3-aminopyrazine-2-carboxylate Traditional Name: 3-aminopyrazinic acid [2-keto-2-[[(1R)-1-phenylbutyl]amino]ethyl] ester Formula: C17H20N4O3 MolecularWeight: 328.3657

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)COC(=O)C2=NC=CN=C2N

Isomeric SMILES

CCC[C@H](C1=CC=CC=C1)NC(=O)COC(=O)C2=NC=CN=C2N

InChI

InChI=1S/C17H20N4O3/c1-2-6-13(12-7-4-3-5-8-12)21-14(22)11-24-17(23)15-16(18)20-10-9-19-15/h3-5,7-10,13H,2,6,11H2,1H3,(H2,18,20)(H,21,22)/t13-/m1/s1