[(2R,3S,4R,5R)-5-(3-aminocarbonyl-1,2,4-triazol-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl (2S)-2,4-bis(azanyl)butanoate

Systemtic Name: [(2R,3S,4R,5R)-5-(3-aminocarbonyl-1,2,4-triazol-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl (2S)-2,4-bis(azanyl)butanoate Openeye Name: [(2R,3S,4R,5R)-5-(3-carbamoyl-1,2,4-triazol-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl (2S)-2,4-diaminobutanoate CAS Name: (2S)-2,4-diaminobutanoic acid [(2R,3S,4R,5R)-5-(3-carbamoyl-1,2,4-triazol-1-yl)-3,4-dihydroxy-2-oxolanyl]methyl ester IUPAC Name: [(2R,3S,4R,5R)-5-(3-carbamoyl-1,2,4-triazol-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl (2S)-2,4-diaminobutanoate Traditional Name: (2S)-2,4-diaminobutyric acid [(2R,3S,4R,5R)-5-(3-carbamoyl-1,2,4-triazol-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl ester Formula: C12H20N6O6 MolecularWeight: 344.3238

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=NN1C2C(C(C(O2)COC(=O)C(CCN)N)O)O)C(=O)N

Isomeric SMILES

C1=NC(=NN1[C@H]2[C@@H]([C@@H]([C@H](O2)COC(=O)[C@H](CCN)N)O)O)C(=O)N

InChI

InChI=1S/C12H20N6O6/c13-2-1-5(14)12(22)23-3-6-7(19)8(20)11(24-6)18-4-16-10(17-18)9(15)21/h4-8,11,19-20H,1-3,13-14H2,(H2,15,21)/t5-,6+,7+,8+,11+/m0/s1