methyl 3-[2,3-bis(oxidanyl)propylamino]pyrazine-2-carboxylate

Systemtic Name: methyl 3-[2,3-bis(oxidanyl)propylamino]pyrazine-2-carboxylate Openeye Name: methyl 3-(2,3-dihydroxypropylamino)pyrazine-2-carboxylate CAS Name: 3-(2,3-dihydroxypropylamino)-2-pyrazinecarboxylic acid methyl ester IUPAC Name: methyl 3-(2,3-dihydroxypropylamino)pyrazine-2-carboxylate Traditional Name: 3-(glycerylamino)pyrazinic acid methyl ester Formula: C9H13N3O4 MolecularWeight: 227.21722

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC=CN=C1NCC(CO)O

Isomeric SMILES

COC(=O)C1=NC=CN=C1NCC(CO)O

InChI

InChI=1S/C9H13N3O4/c1-16-9(15)7-8(11-3-2-10-7)12-4-6(14)5-13/h2-3,6,13-14H,4-5H2,1H3,(H,11,12)