[(3S,3aS,4S,6aR)-4-methyl-6-oxidanylidene-1-[(1S)-1-phenylethyl]-3,3a,4,6a-tetrahydrofuro[3,4-c][1,2]oxazol-3-yl]methyl 2,2-dimethylpropanoate

Systemtic Name: [(3S,3aS,4S,6aR)-4-methyl-6-oxidanylidene-1-[(1S)-1-phenylethyl]-3,3a,4,6a-tetrahydrofuro[3,4-c][1,2]oxazol-3-yl]methyl 2,2-dimethylpropanoate Openeye Name: [(3S,3aS,4S,6aR)-4-methyl-6-oxo-1-[(1S)-1-phenylethyl]-3,3a,4,6a-tetrahydrofuro[3,4-c]isoxazol-3-yl]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(3S,3aS,4S,6aR)-4-methyl-6-oxo-1-[(1S)-1-phenylethyl]-3,3a,4,6a-tetrahydrofuro[3,4-c]isoxazol-3-yl]methyl ester IUPAC Name: [(3S,3aS,4S,6aR)-4-methyl-6-oxo-1-[(1S)-1-phenylethyl]-3,3a,4,6a-tetrahydrofuro[3,4-c][1,2]oxazol-3-yl]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(3S,3aS,4S,6aR)-6-keto-4-methyl-1-[(1S)-1-phenylethyl]-3,3a,4,6a-tetrahydrofur[3,4-c]isoxazol-3-yl]methyl ester Formula: C20H27NO5 MolecularWeight: 361.43208

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2C(ON(C2C(=O)O1)C(C)C3=CC=CC=C3)COC(=O)C(C)(C)C

Isomeric SMILES

C[C@H]1[C@H]2[C@H](ON([C@H]2C(=O)O1)[C@@H](C)C3=CC=CC=C3)COC(=O)C(C)(C)C

InChI

InChI=1S/C20H27NO5/c1-12(14-9-7-6-8-10-14)21-17-16(13(2)25-18(17)22)15(26-21)11-24-19(23)20(3,4)5/h6-10,12-13,15-17H,11H2,1-5H3/t12-,13-,15+,16-,17+/m0/s1