7-bromanyl-9-chloranyl-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-9-chloranyl-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-9-chloro-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-9-chloro-6-hydroxy-2-[(1S)-1-hydroxy-3-methylbutyl]-1-methoxy-8-methyl-10H-benzo[b][1,5]benzodioxocin-12-one IUPAC Name: 7-bromo-9-chloro-6-hydroxy-2-[(1S)-1-hydroxy-3-methylbutyl]-1-methoxy-8-methyl-10H-benzo[b][1,5]benzodioxocin-12-one Traditional Name: 7-bromo-9-chloro-6-hydroxy-2-[(1S)-1-hydroxy-3-methyl-butyl]-1-methoxy-8-methyl-10H-benzo[b][1,5]benzodioxocin-12-one Formula: C21H22BrClO6 MolecularWeight: 485.75278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C(=C1Br)O)OC3=C(C(=C(C=C3)C(CC(C)C)O)OC)C(=O)OC2)Cl

Isomeric SMILES

CC1=C(C2=C(C(=C1Br)O)OC3=C(C(=C(C=C3)[C@H](CC(C)C)O)OC)C(=O)OC2)Cl

InChI

InChI=1S/C21H22BrClO6/c1-9(2)7-13(24)11-5-6-14-15(19(11)27-4)21(26)28-8-12-17(23)10(3)16(22)18(25)20(12)29-14/h5-6,9,13,24-25H,7-8H2,1-4H3/t13-/m0/s1