(2S,3R,3aR)-3a-methoxy-2-(7-methoxy-1,3-benzodioxol-5-yl)-3-methyl-5-prop-2-enyl-2,3-dihydro-1-benzofuran-6-one

Systemtic Name: (2S,3R,3aR)-3a-methoxy-2-(7-methoxy-1,3-benzodioxol-5-yl)-3-methyl-5-prop-2-enyl-2,3-dihydro-1-benzofuran-6-one Openeye Name: (2S,3R,3aR)-5-allyl-3a-methoxy-2-(7-methoxy-1,3-benzodioxol-5-yl)-3-methyl-2,3-dihydrobenzofuran-6-one CAS Name: (2S,3R,3aR)-3a-methoxy-2-(7-methoxy-1,3-benzodioxol-5-yl)-3-methyl-5-prop-2-enyl-2,3-dihydrobenzofuran-6-one IUPAC Name: (2S,3R,3aR)-3a-methoxy-2-(7-methoxy-1,3-benzodioxol-5-yl)-3-methyl-5-prop-2-enyl-2,3-dihydro-1-benzofuran-6-one Traditional Name: (2S,3R,3aR)-5-allyl-3a-methoxy-2-(7-methoxy-1,3-benzodioxol-5-yl)-3-methyl-2,3-dihydrobenzofuran-6-one Formula: C21H22O6 MolecularWeight: 370.39578

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC2=CC(=O)C(=CC12OC)CC=C)C3=CC4=C(C(=C3)OC)OCO4

Isomeric SMILES

C[C@@H]1[C@H](OC2=CC(=O)C(=C[C@@]12OC)CC=C)C3=CC4=C(C(=C3)OC)OCO4

InChI

InChI=1S/C21H22O6/c1-5-6-13-10-21(24-4)12(2)19(27-18(21)9-15(13)22)14-7-16(23-3)20-17(8-14)25-11-26-20/h5,7-10,12,19H,1,6,11H2,2-4H3/t12-,19+,21-/m1/s1