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

Systemtic Name: 9-bromanyl-1-methoxy-8-methyl-6-(3-methylbutoxy)-2-[(1S)-3-methyl-1-oxidanyl-butyl]-10H-benzo[b][1,5]benzodioxocin-12-one Openeye Name: 9-bromo-2-[(1S)-1-hydroxy-3-methyl-butyl]-6-isopentyloxy-1-methoxy-8-methyl-10H-benzo[b][1,5]benzodioxocin-12-one CAS Name: 9-bromo-2-[(1S)-1-hydroxy-3-methylbutyl]-1-methoxy-8-methyl-6-(3-methylbutoxy)-10H-benzo[b][1,5]benzodioxocin-12-one IUPAC Name: 9-bromo-2-[(1S)-1-hydroxy-3-methylbutyl]-1-methoxy-8-methyl-6-(3-methylbutoxy)-10H-benzo[b][1,5]benzodioxocin-12-one Traditional Name: 9-bromo-2-[(1S)-1-hydroxy-3-methyl-butyl]-6-isoamoxy-1-methoxy-8-methyl-10H-benzo[b][1,5]benzodioxocin-12-one Formula: C26H33BrO6 MolecularWeight: 521.44062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1Br)COC(=O)C3=C(O2)C=CC(=C3OC)C(CC(C)C)O)OCCC(C)C

Isomeric SMILES

CC1=CC(=C2C(=C1Br)COC(=O)C3=C(O2)C=CC(=C3OC)[C@H](CC(C)C)O)OCCC(C)C

InChI

InChI=1S/C26H33BrO6/c1-14(2)9-10-31-21-12-16(5)23(27)18-13-32-26(29)22-20(33-24(18)21)8-7-17(25(22)30-6)19(28)11-15(3)4/h7-8,12,14-15,19,28H,9-11,13H2,1-6H3/t19-/m0/s1