(9aZ)-6-cycloheptyloxy-1-methoxy-8-methyl-2-(3-methyl-1-oxidanyl-butyl)-9H-benzo[b][1,5]benzodioxocin-12-one

Systemtic Name: (9aZ)-6-cycloheptyloxy-1-methoxy-8-methyl-2-(3-methyl-1-oxidanyl-butyl)-9H-benzo[b][1,5]benzodioxocin-12-one Openeye Name: (9aZ)-6-(cycloheptoxy)-2-(1-hydroxy-3-methyl-butyl)-1-methoxy-8-methyl-9H-benzo[b][1,5]benzodioxocin-12-one CAS Name: (9aZ)-6-cycloheptyloxy-2-(1-hydroxy-3-methylbutyl)-1-methoxy-8-methyl-9H-benzo[b][1,5]benzodioxocin-12-one IUPAC Name: (9aZ)-6-cycloheptyloxy-2-(1-hydroxy-3-methylbutyl)-1-methoxy-8-methyl-9H-benzo[b][1,5]benzodioxocin-12-one Traditional Name: (9aZ)-6-(cycloheptoxy)-2-(1-hydroxy-3-methyl-butyl)-1-methoxy-8-methyl-9H-benzo[b][1,5]benzodioxocin-12-one Formula: C28H36O6 MolecularWeight: 468.58184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=COC(=O)C3=C(O2)C=CC(=C3OC)C(CC(C)C)O)C1)OC4CCCCCC4

Isomeric SMILES

CC1=CC(=C2/C(=C\OC(=O)C3=C(O2)C=CC(=C3OC)C(CC(C)C)O)/C1)OC4CCCCCC4

InChI

InChI=1S/C28H36O6/c1-17(2)13-22(29)21-11-12-23-25(27(21)31-4)28(30)32-16-19-14-18(3)15-24(26(19)34-23)33-20-9-7-5-6-8-10-20/h11-12,15-17,20,22,29H,5-10,13-14H2,1-4H3/b19-16-