[6-acetamido-4,4-bis(bromanyl)-2,6-dimethyl-5-oxidanylidene-heptan-3-yl] ethanoate

Systemtic Name: [6-acetamido-4,4-bis(bromanyl)-2,6-dimethyl-5-oxidanylidene-heptan-3-yl] ethanoate Openeye Name: (4-acetamido-2,2-dibromo-1-isopropyl-4-methyl-3-oxo-pentyl) acetate CAS Name: acetic acid (6-acetamido-4,4-dibromo-2,6-dimethyl-5-oxoheptan-3-yl) ester IUPAC Name: (6-acetamido-4,4-dibromo-2,6-dimethyl-5-oxoheptan-3-yl) acetate Traditional Name: acetic acid (4-acetamido-2,2-dibromo-1-isopropyl-3-keto-4-methyl-pentyl) ester Formula: C13H21Br2NO4 MolecularWeight: 415.11814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21Br2NO4/c1-7(2)10(20-9(4)18)13(14,15)11(19)12(5,6)16-8(3)17/h7,10H,1-6H3,(H,16,17)