(3S,5S)-3,5-bis(5-bromanyl-2,4-dimethoxy-phenyl)-4-ethanoyl-cyclohexan-1-one

Systemtic Name: (3S,5S)-3,5-bis(5-bromanyl-2,4-dimethoxy-phenyl)-4-ethanoyl-cyclohexan-1-one Openeye Name: (3S,5S)-4-acetyl-3,5-bis(5-bromo-2,4-dimethoxy-phenyl)cyclohexanone CAS Name: (3S,5S)-4-acetyl-3,5-bis(5-bromo-2,4-dimethoxyphenyl)-1-cyclohexanone IUPAC Name: (3S,5S)-4-acetyl-3,5-bis(5-bromo-2,4-dimethoxyphenyl)cyclohexan-1-one Traditional Name: (3S,5S)-4-acetyl-3,5-bis(5-bromo-2,4-dimethoxy-phenyl)cyclohexanone Formula: C24H26Br2O6 MolecularWeight: 570.26764

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(CC(=O)CC1C2=CC(=C(C=C2OC)OC)Br)C3=CC(=C(C=C3OC)OC)Br

Isomeric SMILES

CC(=O)C1[C@H](CC(=O)C[C@@H]1C2=CC(=C(C=C2OC)OC)Br)C3=CC(=C(C=C3OC)OC)Br

InChI

InChI=1S/C24H26Br2O6/c1-12(27)24-16(14-8-18(25)22(31-4)10-20(14)29-2)6-13(28)7-17(24)15-9-19(26)23(32-5)11-21(15)30-3/h8-11,16-17,24H,6-7H2,1-5H3/t16-,17-/m1/s1