methyl (2E)-2-[(2S,6S)-2-ethyl-6-(2-oxidanylideneoctyl)oxan-4-ylidene]ethanoate

Systemtic Name: methyl (2E)-2-[(2S,6S)-2-ethyl-6-(2-oxidanylideneoctyl)oxan-4-ylidene]ethanoate Openeye Name: methyl (2E)-2-[(2S,6S)-2-ethyl-6-(2-oxooctyl)tetrahydropyran-4-ylidene]acetate CAS Name: (2E)-2-[(2S,6S)-2-ethyl-6-(2-oxooctyl)-4-oxanylidene]acetic acid methyl ester IUPAC Name: methyl (2E)-2-[(2S,6S)-2-ethyl-6-(2-oxooctyl)oxan-4-ylidene]acetate Traditional Name: (2E)-2-[(2S,6S)-2-ethyl-6-(2-ketooctyl)tetrahydropyran-4-ylidene]acetic acid methyl ester Formula: C18H30O4 MolecularWeight: 310.4284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)CC1CC(=CC(=O)OC)CC(O1)CC

Isomeric SMILES

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

InChI

InChI=1S/C18H30O4/c1-4-6-7-8-9-15(19)13-17-11-14(12-18(20)21-3)10-16(5-2)22-17/h12,16-17H,4-11,13H2,1-3H3/b14-12+/t16-,17-/m0/s1