(E)-5-[6-(2-methoxypropan-2-yloxymethyl)-5-(oxan-2-yloxy)-1,3a,4,5,6,6a-hexahydropentalen-2-yl]pent-4-enoic acid

Systemtic Name: (E)-5-[6-(2-methoxypropan-2-yloxymethyl)-5-(oxan-2-yloxy)-1,3a,4,5,6,6a-hexahydropentalen-2-yl]pent-4-enoic acid Openeye Name: (E)-5-[6-[(1-methoxy-1-methyl-ethoxy)methyl]-5-tetrahydropyran-2-yloxy-1,3a,4,5,6,6a-hexahydropentalen-2-yl]pent-4-enoic acid CAS Name: (E)-5-[6-(2-methoxypropan-2-yloxymethyl)-5-(2-oxanyloxy)-1,3a,4,5,6,6a-hexahydropentalen-2-yl]-4-pentenoic acid IUPAC Name: (E)-5-[6-(2-methoxypropan-2-yloxymethyl)-5-(oxan-2-yloxy)-1,3a,4,5,6,6a-hexahydropentalen-2-yl]pent-4-enoic acid Traditional Name: (E)-5-[6-[(1-methoxy-1-methyl-ethoxy)methyl]-5-tetrahydropyran-2-yloxy-1,3a,4,5,6,6a-hexahydropentalen-2-yl]pent-4-enoic acid Formula: C23H36O6 MolecularWeight: 408.52834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(OC)OCC1C(CC2C1CC(=C2)C=CCCC(=O)O)OC3CCCCO3

Isomeric SMILES

CC(C)(OC)OCC1C(CC2C1CC(=C2)/C=C/CCC(=O)O)OC3CCCCO3

InChI

InChI=1S/C23H36O6/c1-23(2,26-3)28-15-19-18-13-16(8-4-5-9-21(24)25)12-17(18)14-20(19)29-22-10-6-7-11-27-22/h4,8,12,17-20,22H,5-7,9-11,13-15H2,1-3H3,(H,24,25)/b8-4+