[(7R)-7-ethyl-3-methanoyl-7-methyl-4H-oxepin-6-yl] ethanoate

Systemtic Name: [(7R)-7-ethyl-3-methanoyl-7-methyl-4H-oxepin-6-yl] ethanoate Openeye Name: [(7R)-7-ethyl-3-formyl-7-methyl-4H-oxepin-6-yl] acetate CAS Name: acetic acid [(7R)-7-ethyl-3-formyl-7-methyl-4H-oxepin-6-yl] ester IUPAC Name: [(7R)-7-ethyl-3-formyl-7-methyl-4H-oxepin-6-yl] acetate Traditional Name: acetic acid [(7R)-7-ethyl-3-formyl-7-methyl-4H-oxepin-6-yl] ester Formula: C12H16O4 MolecularWeight: 224.25304

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=CCC(=CO1)C=O)OC(=O)C)C

Isomeric SMILES

CC[C@@]1(C(=CCC(=CO1)C=O)OC(=O)C)C

InChI

InChI=1S/C12H16O4/c1-4-12(3)11(16-9(2)14)6-5-10(7-13)8-15-12/h6-8H,4-5H2,1-3H3/t12-/m1/s1