butyl (3aR,4R,5S,7S)-1,5-dimethyl-4-oxidanyl-2-oxidanylidene-3a,4,5,7-tetrahydro-3H-pyrazolo[1,5-c][1,3]oxazine-7-carboxylate

Systemtic Name: butyl (3aR,4R,5S,7S)-1,5-dimethyl-4-oxidanyl-2-oxidanylidene-3a,4,5,7-tetrahydro-3H-pyrazolo[1,5-c][1,3]oxazine-7-carboxylate Openeye Name: butyl (3aR,4R,5S,7S)-4-hydroxy-1,5-dimethyl-2-oxo-3a,4,5,7-tetrahydro-3H-pyrazolo[1,5-c][1,3]oxazine-7-carboxylate CAS Name: (3aR,4R,5S,7S)-4-hydroxy-1,5-dimethyl-2-oxo-3a,4,5,7-tetrahydro-3H-pyrazolo[1,5-c][1,3]oxazine-7-carboxylic acid butyl ester IUPAC Name: butyl (3aR,4R,5S,7S)-4-hydroxy-1,5-dimethyl-2-oxo-3a,4,5,7-tetrahydro-3H-pyrazolo[1,5-c][1,3]oxazine-7-carboxylate Traditional Name: (3aR,4R,5S,7S)-4-hydroxy-2-keto-1,5-dimethyl-3a,4,5,7-tetrahydro-3H-pyrazolo[1,5-c][1,3]oxazine-7-carboxylic acid butyl ester Formula: C13H22N2O5 MolecularWeight: 286.32418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1N2C(CC(=O)N2C)C(C(O1)C)O

Isomeric SMILES

CCCCOC(=O)[C@H]1N2[C@H](CC(=O)N2C)[C@H]([C@@H](O1)C)O

InChI

InChI=1S/C13H22N2O5/c1-4-5-6-19-13(18)12-15-9(7-10(16)14(15)3)11(17)8(2)20-12/h8-9,11-12,17H,4-7H2,1-3H3/t8-,9+,11-,12-/m0/s1