[1,1,1-tris(chloranyl)-2-methyl-propan-2-yl] (3R)-3,6-dimethyl-2-oxidanylidene-1-benzofuran-3-carboxylate

Systemtic Name: [1,1,1-tris(chloranyl)-2-methyl-propan-2-yl] (3R)-3,6-dimethyl-2-oxidanylidene-1-benzofuran-3-carboxylate Openeye Name: (2,2,2-trichloro-1,1-dimethyl-ethyl) (3R)-3,6-dimethyl-2-oxo-benzofuran-3-carboxylate CAS Name: (3R)-3,6-dimethyl-2-oxo-3-benzofurancarboxylic acid (1,1,1-trichloro-2-methylpropan-2-yl) ester IUPAC Name: (1,1,1-trichloro-2-methylpropan-2-yl) (3R)-3,6-dimethyl-2-oxo-1-benzofuran-3-carboxylate Traditional Name: (3R)-2-keto-3,6-dimethyl-coumaran-3-carboxylic acid (2,2,2-trichloro-1,1-dimethyl-ethyl) ester Formula: C15H15Cl3O4 MolecularWeight: 365.6362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(C(=O)O2)(C)C(=O)OC(C)(C)C(Cl)(Cl)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)[C@@](C(=O)O2)(C)C(=O)OC(C)(C)C(Cl)(Cl)Cl

InChI

InChI=1S/C15H15Cl3O4/c1-8-5-6-9-10(7-8)21-11(19)14(9,4)12(20)22-13(2,3)15(16,17)18/h5-7H,1-4H3/t14-/m1/s1