methyl 2-[(2R,7R)-3-oxidanylidene-7-propan-2-yl-oxepan-2-yl]ethanoate

Systemtic Name: methyl 2-[(2R,7R)-3-oxidanylidene-7-propan-2-yl-oxepan-2-yl]ethanoate Openeye Name: methyl 2-[(2R,7R)-7-isopropyl-3-oxo-oxepan-2-yl]acetate CAS Name: 2-[(2R,7R)-3-oxo-7-propan-2-yl-2-oxepanyl]acetic acid methyl ester IUPAC Name: methyl 2-[(2R,7R)-3-oxo-7-propan-2-yloxepan-2-yl]acetate Traditional Name: 2-[(2R,7R)-7-isopropyl-3-keto-oxepan-2-yl]acetic acid methyl ester Formula: C12H20O4 MolecularWeight: 228.2848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CCCC(=O)C(O1)CC(=O)OC

Isomeric SMILES

CC(C)[C@H]1CCCC(=O)[C@H](O1)CC(=O)OC

InChI

InChI=1S/C12H20O4/c1-8(2)10-6-4-5-9(13)11(16-10)7-12(14)15-3/h8,10-11H,4-7H2,1-3H3/t10-,11-/m1/s1