O3-tert-butyl O4-methyl (4S,5S)-5-(1H-imidazol-5-yl)-2-oxidanylidene-1,3-oxazolidine-3,4-dicarboxylate

Systemtic Name: O3-tert-butyl O4-methyl (4S,5S)-5-(1H-imidazol-5-yl)-2-oxidanylidene-1,3-oxazolidine-3,4-dicarboxylate Openeye Name: O3-tert-butyl O4-methyl (4S,5S)-5-(1H-imidazol-5-yl)-2-oxo-oxazolidine-3,4-dicarboxylate CAS Name: (4S,5S)-5-(1H-imidazol-5-yl)-2-oxooxazolidine-3,4-dicarboxylic acid O3-tert-butyl ester O4-methyl ester IUPAC Name: 3-O-tert-butyl 4-O-methyl (4S,5S)-5-(1H-imidazol-5-yl)-2-oxo-1,3-oxazolidine-3,4-dicarboxylate Traditional Name: (4S,5S)-5-(1H-imidazol-5-yl)-2-keto-oxazolidine-3,4-dicarboxylic acid O3-tert-butyl ester O4-methyl ester Formula: C13H17N3O6 MolecularWeight: 311.29058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(C(OC1=O)C2=CN=CN2)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@@H]([C@H](OC1=O)C2=CN=CN2)C(=O)OC

InChI

InChI=1S/C13H17N3O6/c1-13(2,3)22-12(19)16-8(10(17)20-4)9(21-11(16)18)7-5-14-6-15-7/h5-6,8-9H,1-4H3,(H,14,15)/t8-,9+/m0/s1