ethyl (3R,6R,7R,8S,8aS)-6-azido-7-oxidanyl-5-oxidanylidene-8-phenylmethoxy-2,3,6,7,8,8a-hexahydro-[1,3]thiazolo[3,2-a]pyridine-3-carboxylate

Systemtic Name: ethyl (3R,6R,7R,8S,8aS)-6-azido-7-oxidanyl-5-oxidanylidene-8-phenylmethoxy-2,3,6,7,8,8a-hexahydro-[1,3]thiazolo[3,2-a]pyridine-3-carboxylate Openeye Name: ethyl (3R,6R,7R,8S,8aS)-6-azido-8-benzyloxy-7-hydroxy-5-oxo-2,3,6,7,8,8a-hexahydrothiazolo[3,2-a]pyridine-3-carboxylate CAS Name: (3R,6R,7R,8S,8aS)-6-azido-7-hydroxy-5-oxo-8-phenylmethoxy-2,3,6,7,8,8a-hexahydrothiazolo[3,2-a]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl (3R,6R,7R,8S,8aS)-6-azido-7-hydroxy-5-oxo-8-phenylmethoxy-2,3,6,7,8,8a-hexahydro-[1,3]thiazolo[3,2-a]pyridine-3-carboxylate Traditional Name: (3R,6R,7R,8S,8aS)-6-azido-8-benzoxy-7-hydroxy-5-keto-2,3,6,7,8,8a-hexahydrothiazolo[3,2-a]pyridine-3-carboxylic acid ethyl ester Formula: C17H20N4O5S MolecularWeight: 392.4295

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSC2N1C(=O)C(C(C2OCC3=CC=CC=C3)O)N=[N+]=[N-]

Isomeric SMILES

CCOC(=O)[C@@H]1CS[C@@H]2N1C(=O)[C@@H]([C@H]([C@@H]2OCC3=CC=CC=C3)O)N=[N+]=[N-]

InChI

InChI=1S/C17H20N4O5S/c1-2-25-17(24)11-9-27-16-14(26-8-10-6-4-3-5-7-10)13(22)12(19-20-18)15(23)21(11)16/h3-7,11-14,16,22H,2,8-9H2,1H3/t11-,12+,13+,14-,16-/m0/s1