tert-butyl 2-[(2S,4S,6S)-6-cyano-4-phenylmethoxy-oxan-2-yl]ethanoate

Systemtic Name: tert-butyl 2-[(2S,4S,6S)-6-cyano-4-phenylmethoxy-oxan-2-yl]ethanoate Openeye Name: tert-butyl 2-[(2S,4S,6S)-4-benzyloxy-6-cyano-tetrahydropyran-2-yl]acetate CAS Name: 2-[(2S,4S,6S)-6-cyano-4-phenylmethoxy-2-oxanyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(2S,4S,6S)-6-cyano-4-phenylmethoxyoxan-2-yl]acetate Traditional Name: 2-[(2S,4S,6S)-4-benzoxy-6-cyano-tetrahydropyran-2-yl]acetic acid tert-butyl ester Formula: C19H25NO4 MolecularWeight: 331.4061

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC1CC(CC(O1)C#N)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)C[C@@H]1C[C@@H](C[C@H](O1)C#N)OCC2=CC=CC=C2

InChI

InChI=1S/C19H25NO4/c1-19(2,3)24-18(21)11-16-9-15(10-17(12-20)23-16)22-13-14-7-5-4-6-8-14/h4-8,15-17H,9-11,13H2,1-3H3/t15-,16-,17-/m0/s1