tert-butyl 2-[(3R,6S,7aS)-5-oxidanylidene-3-propan-2-yl-3,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-6-yl]ethanoate

Systemtic Name: tert-butyl 2-[(3R,6S,7aS)-5-oxidanylidene-3-propan-2-yl-3,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-6-yl]ethanoate Openeye Name: tert-butyl 2-[(3R,6S,7aS)-3-isopropyl-5-oxo-3,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c]oxazol-6-yl]acetate CAS Name: 2-[(3R,6S,7aS)-5-oxo-3-propan-2-yl-3,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c]oxazol-6-yl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(3R,6S,7aS)-5-oxo-3-propan-2-yl-3,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-6-yl]acetate Traditional Name: 2-[(3R,6S,7aS)-3-isopropyl-5-keto-3,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c]oxazol-6-yl]acetic acid tert-butyl ester Formula: C15H25NO4 MolecularWeight: 283.3633

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1N2C(CC(C2=O)CC(=O)OC(C)(C)C)CO1

Isomeric SMILES

CC(C)[C@@H]1N2[C@@H](C[C@H](C2=O)CC(=O)OC(C)(C)C)CO1

InChI

InChI=1S/C15H25NO4/c1-9(2)14-16-11(8-19-14)6-10(13(16)18)7-12(17)20-15(3,4)5/h9-11,14H,6-8H2,1-5H3/t10-,11-,14+/m0/s1