1-methoxy-8-methyl-6-(3-methylbutoxy)-2-[(1S)-3-methyl-1-oxidanyl-butyl]-9-prop-2-enyl-10H-benzo[b][1,5]benzodioxocin-12-one

Systemtic Name: 1-methoxy-8-methyl-6-(3-methylbutoxy)-2-[(1S)-3-methyl-1-oxidanyl-butyl]-9-prop-2-enyl-10H-benzo[b][1,5]benzodioxocin-12-one Openeye Name: 9-allyl-2-[(1S)-1-hydroxy-3-methyl-butyl]-6-isopentyloxy-1-methoxy-8-methyl-10H-benzo[b][1,5]benzodioxocin-12-one CAS Name: 2-[(1S)-1-hydroxy-3-methylbutyl]-1-methoxy-8-methyl-6-(3-methylbutoxy)-9-prop-2-enyl-10H-benzo[b][1,5]benzodioxocin-12-one IUPAC Name: 2-[(1S)-1-hydroxy-3-methylbutyl]-1-methoxy-8-methyl-6-(3-methylbutoxy)-9-prop-2-enyl-10H-benzo[b][1,5]benzodioxocin-12-one Traditional Name: 9-allyl-2-[(1S)-1-hydroxy-3-methyl-butyl]-6-isoamoxy-1-methoxy-8-methyl-10H-benzo[b][1,5]benzodioxocin-12-one Formula: C29H38O6 MolecularWeight: 482.60842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1CC=C)COC(=O)C3=C(O2)C=CC(=C3OC)C(CC(C)C)O)OCCC(C)C

Isomeric SMILES

CC1=CC(=C2C(=C1CC=C)COC(=O)C3=C(O2)C=CC(=C3OC)[C@H](CC(C)C)O)OCCC(C)C

InChI

InChI=1S/C29H38O6/c1-8-9-20-19(6)15-25(33-13-12-17(2)3)27-22(20)16-34-29(31)26-24(35-27)11-10-21(28(26)32-7)23(30)14-18(4)5/h8,10-11,15,17-18,23,30H,1,9,12-14,16H2,2-7H3/t23-/m0/s1