methyl 2-[(2S,3R)-3-phenylmethoxyoxepan-2-yl]ethanoate

Systemtic Name: methyl 2-[(2S,3R)-3-phenylmethoxyoxepan-2-yl]ethanoate Openeye Name: methyl 2-[(2S,3R)-3-benzyloxyoxepan-2-yl]acetate CAS Name: 2-[(2S,3R)-3-phenylmethoxy-2-oxepanyl]acetic acid methyl ester IUPAC Name: methyl 2-[(2S,3R)-3-phenylmethoxyoxepan-2-yl]acetate Traditional Name: 2-[(2S,3R)-3-benzoxyoxepan-2-yl]acetic acid methyl ester Formula: C16H22O4 MolecularWeight: 278.34348

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C(CCCCO1)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C[C@H]1[C@@H](CCCCO1)OCC2=CC=CC=C2

InChI

InChI=1S/C16H22O4/c1-18-16(17)11-15-14(9-5-6-10-19-15)20-12-13-7-3-2-4-8-13/h2-4,7-8,14-15H,5-6,9-12H2,1H3/t14-,15+/m1/s1