4-(1,3-benzodioxol-5-ylmethyl)-3-[[3-oxidanyl-4,5-bis(trideuteriomethoxy)phenyl]methyl]oxolan-2-one

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethyl)-3-[[3-oxidanyl-4,5-bis(trideuteriomethoxy)phenyl]methyl]oxolan-2-one Openeye Name: 4-(1,3-benzodioxol-5-ylmethyl)-3-[[3-hydroxy-4,5-bis(trideuteriomethoxy)phenyl]methyl]tetrahydrofuran-2-one CAS Name: 4-(1,3-benzodioxol-5-ylmethyl)-3-[[3-hydroxy-4,5-bis(trideuteriomethoxy)phenyl]methyl]-2-oxolanone IUPAC Name: 4-(1,3-benzodioxol-5-ylmethyl)-3-[[3-hydroxy-4,5-bis(trideuteriomethoxy)phenyl]methyl]oxolan-2-one Traditional Name: 3-[3-hydroxy-4,5-bis(trideuteriomethoxy)benzyl]-4-piperonyl-tetrahydrofuran-2-one Formula: C21H22O7 MolecularWeight: 392.432151

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)O)CC2C(COC2=O)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

[2H]C([2H])([2H])OC1=CC(=CC(=C1OC([2H])([2H])[2H])O)CC2C(COC2=O)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H22O7/c1-24-19-9-13(7-16(22)20(19)25-2)6-15-14(10-26-21(15)23)5-12-3-4-17-18(8-12)28-11-27-17/h3-4,7-9,14-15,22H,5-6,10-11H2,1-2H3/i1D3,2D3