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

Systemtic Name: 7-bromanyl-1-methoxy-8-methyl-2-[(1S)-3-methyl-1-oxidanyl-butyl]-6-oxidanyl-10H-benzo[b][1,5]benzodioxocin-12-one Openeye Name: 7-bromo-6-hydroxy-2-[(1S)-1-hydroxy-3-methyl-butyl]-1-methoxy-8-methyl-10H-benzo[b][1,5]benzodioxocin-12-one CAS Name: 7-bromo-6-hydroxy-2-[(1S)-1-hydroxy-3-methylbutyl]-1-methoxy-8-methyl-10H-benzo[b][1,5]benzodioxocin-12-one IUPAC Name: 7-bromo-6-hydroxy-2-[(1S)-1-hydroxy-3-methylbutyl]-1-methoxy-8-methyl-10H-benzo[b][1,5]benzodioxocin-12-one Traditional Name: 7-bromo-6-hydroxy-2-[(1S)-1-hydroxy-3-methyl-butyl]-1-methoxy-8-methyl-10H-benzo[b][1,5]benzodioxocin-12-one Formula: C21H23BrO6 MolecularWeight: 451.30772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C(=C2C(=C1)COC(=O)C3=C(O2)C=CC(=C3OC)[C@H](CC(C)C)O)O)Br

InChI

InChI=1S/C21H23BrO6/c1-10(2)7-14(23)13-5-6-15-16(20(13)26-4)21(25)27-9-12-8-11(3)17(22)18(24)19(12)28-15/h5-6,8,10,14,23-24H,7,9H2,1-4H3/t14-/m0/s1