ethyl 3-[(3aR,4aS,5S,6S,8aR,8bR)-5-(iodanylmethyl)-2,2,6-trimethyl-4a,5,7,8,8a,8b-hexahydro-3aH-[1,3]dioxolo[4,5-b][1]benzofuran-6-yl]propanoate

Systemtic Name: ethyl 3-[(3aR,4aS,5S,6S,8aR,8bR)-5-(iodanylmethyl)-2,2,6-trimethyl-4a,5,7,8,8a,8b-hexahydro-3aH-[1,3]dioxolo[4,5-b][1]benzofuran-6-yl]propanoate Openeye Name: ethyl 3-[(3aR,4aS,5S,6S,8aR,8bR)-5-(iodomethyl)-2,2,6-trimethyl-4a,5,7,8,8a,8b-hexahydro-3aH-[1,3]dioxolo[4,5-b]benzofuran-6-yl]propanoate CAS Name: 3-[(3aR,4aS,5S,6S,8aR,8bR)-5-(iodomethyl)-2,2,6-trimethyl-4a,5,7,8,8a,8b-hexahydro-3aH-[1,3]dioxolo[4,5-b]benzofuran-6-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(3aR,4aS,5S,6S,8aR,8bR)-5-(iodomethyl)-2,2,6-trimethyl-4a,5,7,8,8a,8b-hexahydro-3aH-[1,3]dioxolo[4,5-b][1]benzofuran-6-yl]propanoate Traditional Name: 3-[(3aR,4aS,5S,6S,8aR,8bR)-5-(iodomethyl)-2,2,6-trimethyl-4a,5,7,8,8a,8b-hexahydro-3aH-[1,3]dioxolo[4,5-b]benzofuran-6-yl]propionic acid ethyl ester Formula: C18H29IO5 MolecularWeight: 452.32433

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1(CCC2C(C1CI)OC3C2OC(O3)(C)C)C

Isomeric SMILES

CCOC(=O)CC[C@@]1(CC[C@@H]2[C@@H]([C@H]1CI)O[C@H]3[C@@H]2OC(O3)(C)C)C

InChI

InChI=1S/C18H29IO5/c1-5-21-13(20)7-9-18(4)8-6-11-14(12(18)10-19)22-16-15(11)23-17(2,3)24-16/h11-12,14-16H,5-10H2,1-4H3/t11-,12-,14+,15-,16-,18+/m1/s1