methyl (E)-3-[(2S,3R)-3-acetyloxyoxepan-2-yl]prop-2-enoate

Systemtic Name: methyl (E)-3-[(2S,3R)-3-acetyloxyoxepan-2-yl]prop-2-enoate Openeye Name: methyl (E)-3-[(2S,3R)-3-acetoxyoxepan-2-yl]prop-2-enoate CAS Name: (E)-3-[(2S,3R)-3-acetyloxy-2-oxepanyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[(2S,3R)-3-acetyloxyoxepan-2-yl]prop-2-enoate Traditional Name: (E)-3-[(2S,3R)-3-acetoxyoxepan-2-yl]acrylic acid methyl ester Formula: C12H18O5 MolecularWeight: 242.26832

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCCCOC1C=CC(=O)OC

Isomeric SMILES

CC(=O)O[C@@H]1CCCCO[C@H]1/C=C/C(=O)OC

InChI

InChI=1S/C12H18O5/c1-9(13)17-11-5-3-4-8-16-10(11)6-7-12(14)15-2/h6-7,10-11H,3-5,8H2,1-2H3/b7-6+/t10-,11+/m0/s1