2,2-bis(3-chloranyl-4-fluoranyl-phenyl)-2-oxidanyl-ethanoate; bromanylmethane

Systemtic Name: 2,2-bis(3-chloranyl-4-fluoranyl-phenyl)-2-oxidanyl-ethanoate; bromanylmethane Openeye Name: 2,2-bis(3-chloro-4-fluoro-phenyl)-2-hydroxy-acetate; bromomethane CAS Name: 2,2-bis(3-chloro-4-fluorophenyl)-2-hydroxyacetate; bromomethane IUPAC Name: 2,2-bis(3-chloro-4-fluorophenyl)-2-hydroxyacetate; bromomethane Traditional Name: 2,2-bis(3-chloro-4-fluoro-phenyl)-2-hydroxy-acetate; bromomethane Formula: C15H10BrCl2F2O3- MolecularWeight: 427.044906

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Descriptors Computed from Structure

Canonical SMILES:

CBr.C1=CC(=C(C=C1C(C2=CC(=C(C=C2)F)Cl)(C(=O)[O-])O)Cl)F

Isomeric SMILES

CBr.C1=CC(=C(C=C1C(C2=CC(=C(C=C2)F)Cl)(C(=O)[O-])O)Cl)F

InChI

InChI=1S/C14H8Cl2F2O3.CH3Br/c15-9-5-7(1-3-11(9)17)14(21,13(19)20)8-2-4-12(18)10(16)6-8;1-2/h1-6,21H,(H,19,20);1H3/p-1