[(5S,5aS,6R,7R)-5-[2-(furan-3-yl)ethyl]-4,5-dimethyl-2-oxidanylidene-spiro[4,5a,6,8,9,9a-hexahydro-3H-benzo[b]oxepine-7,2'-oxirane]-6-yl]methyl ethanoate

Systemtic Name: [(5S,5aS,6R,7R)-5-[2-(furan-3-yl)ethyl]-4,5-dimethyl-2-oxidanylidene-spiro[4,5a,6,8,9,9a-hexahydro-3H-benzo[b]oxepine-7,2'-oxirane]-6-yl]methyl ethanoate Openeye Name: [(5S,5aS,6R,7R)-5-[2-(3-furyl)ethyl]-4,5-dimethyl-2-oxo-spiro[4,5a,6,8,9,9a-hexahydro-3H-benzo[b]oxepine-7,2'-oxirane]-6-yl]methyl acetate CAS Name: acetic acid [(5S,5aS,6R,7R)-5-[2-(3-furanyl)ethyl]-4,5-dimethyl-2-oxo-6-spiro[4,5a,6,8,9,9a-hexahydro-3H-benzo[b]oxepin-7,2'-oxirane]yl]methyl ester IUPAC Name: [(5S,5aS,6R,7R)-5-[2-(furan-3-yl)ethyl]-4,5-dimethyl-2-oxospiro[4,5a,6,8,9,9a-hexahydro-3H-benzo[b]oxepine-7,2'-oxirane]-6-yl]methyl acetate Traditional Name: acetic acid [(5S,5aS,6R,7R)-5-[2-(3-furyl)ethyl]-2-keto-4,5-dimethyl-spiro[4,5a,6,8,9,9a-hexahydro-3H-benzo[b]oxepin-7,2'-oxirane]-6-yl]methyl ester Formula: C22H30O6 MolecularWeight: 390.47

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)OC2CCC3(CO3)C(C2C1(C)CCC4=COC=C4)COC(=O)C

Isomeric SMILES

CC1CC(=O)OC2CC[C@]3(CO3)[C@H]([C@H]2[C@@]1(C)CCC4=COC=C4)COC(=O)C

InChI

InChI=1S/C22H30O6/c1-14-10-19(24)28-18-5-8-22(13-27-22)17(12-26-15(2)23)20(18)21(14,3)7-4-16-6-9-25-11-16/h6,9,11,14,17-18,20H,4-5,7-8,10,12-13H2,1-3H3/t14?,17-,18?,20+,21-,22-/m0/s1