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

Systemtic Name: [1,1,1-tris(chloranyl)-2-methyl-propan-2-yl] (3R)-2-oxidanylidene-3-phenyl-1-benzofuran-3-carboxylate Openeye Name: (2,2,2-trichloro-1,1-dimethyl-ethyl) (3R)-2-oxo-3-phenyl-benzofuran-3-carboxylate CAS Name: (3R)-2-oxo-3-phenyl-3-benzofurancarboxylic acid (1,1,1-trichloro-2-methylpropan-2-yl) ester IUPAC Name: (1,1,1-trichloro-2-methylpropan-2-yl) (3R)-2-oxo-3-phenyl-1-benzofuran-3-carboxylate Traditional Name: (3R)-2-keto-3-phenyl-coumaran-3-carboxylic acid (2,2,2-trichloro-1,1-dimethyl-ethyl) ester Formula: C19H15Cl3O4 MolecularWeight: 413.679

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(Cl)(Cl)Cl)OC(=O)C1(C2=CC=CC=C2OC1=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C(Cl)(Cl)Cl)OC(=O)[C@@]1(C2=CC=CC=C2OC1=O)C3=CC=CC=C3

InChI

InChI=1S/C19H15Cl3O4/c1-17(2,19(20,21)22)26-16(24)18(12-8-4-3-5-9-12)13-10-6-7-11-14(13)25-15(18)23/h3-11H,1-2H3/t18-/m1/s1