[3-acetyloxy-5-carbonobromidoyl-4-ethanoyl-2,4,5-tris(oxidanyl)-6-oxidanylidene-heptyl] ethanoate

Systemtic Name: [3-acetyloxy-5-carbonobromidoyl-4-ethanoyl-2,4,5-tris(oxidanyl)-6-oxidanylidene-heptyl] ethanoate Openeye Name: (3-acetoxy-4-acetyl-5-bromocarbonyl-2,4,5-trihydroxy-6-oxo-heptyl) acetate CAS Name: acetic acid (4-acetyl-3-acetyloxy-5-carbonobromidoyl-2,4,5-trihydroxy-6-oxoheptyl) ester IUPAC Name: (4-acetyl-3-acetyloxy-5-carbonobromidoyl-2,4,5-trihydroxy-6-oxoheptyl) acetate Traditional Name: acetic acid (3-acetoxy-4-acetyl-5-bromocarbonyl-2,4,5-trihydroxy-6-keto-heptyl) ester Formula: C14H19BrO10 MolecularWeight: 427.19866

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(C(COC(=O)C)O)OC(=O)C)(C(C(=O)C)(C(=O)Br)O)O

Isomeric SMILES

CC(=O)C(C(C(COC(=O)C)O)OC(=O)C)(C(C(=O)C)(C(=O)Br)O)O

InChI

InChI=1S/C14H19BrO10/c1-6(16)13(22,14(23,7(2)17)12(15)21)11(25-9(4)19)10(20)5-24-8(3)18/h10-11,20,22-23H,5H2,1-4H3