tert-butyl 2-[(2E)-2-[(3aS,4S,5R,6aS)-4-(hydroxymethyl)-5-(oxan-2-yloxy)-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]ethoxy]ethanoate

Systemtic Name: tert-butyl 2-[(2E)-2-[(3aS,4S,5R,6aS)-4-(hydroxymethyl)-5-(oxan-2-yloxy)-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]ethoxy]ethanoate Openeye Name: tert-butyl 2-[(2E)-2-[(3aS,4S,5R,6aS)-4-(hydroxymethyl)-5-tetrahydropyran-2-yloxy-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]ethoxy]acetate CAS Name: 2-[(2E)-2-[(3aS,4S,5R,6aS)-4-(hydroxymethyl)-5-(2-oxanyloxy)-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]ethoxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(2E)-2-[(3aS,4S,5R,6aS)-4-(hydroxymethyl)-5-(oxan-2-yloxy)-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]ethoxy]acetate Traditional Name: 2-[(2E)-2-[(3aS,4S,5R,6aS)-4-methylol-5-tetrahydropyran-2-yloxy-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]ethoxy]acetic acid tert-butyl ester Formula: C22H36O6 MolecularWeight: 396.51764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)COCC=C1CC2CC(C(C2C1)CO)OC3CCCCO3

Isomeric SMILES

CC(C)(C)OC(=O)COC/C=C/1\C[C@H]2C[C@H]([C@@H]([C@H]2C1)CO)OC3CCCCO3

InChI

InChI=1S/C22H36O6/c1-22(2,3)28-20(24)14-25-9-7-15-10-16-12-19(18(13-23)17(16)11-15)27-21-6-4-5-8-26-21/h7,16-19,21,23H,4-6,8-14H2,1-3H3/b15-7+/t16-,17-,18+,19+,21?/m0/s1