sodium 2-(4-tert-butylcyclohexyl)oxycarbonyl-3,4,5,6-tetrakis(chloranyl)benzoate

Systemtic Name: sodium 2-(4-tert-butylcyclohexyl)oxycarbonyl-3,4,5,6-tetrakis(chloranyl)benzoate Openeye Name: sodium 2-(4-tert-butylcyclohexoxy)carbonyl-3,4,5,6-tetrachloro-benzoate CAS Name: sodium 2-[(4-tert-butylcyclohexyl)oxy-oxomethyl]-3,4,5,6-tetrachlorobenzoate IUPAC Name: sodium 2-(4-tert-butylcyclohexyl)oxycarbonyl-3,4,5,6-tetrachlorobenzoate Traditional Name: sodium 2-(4-tert-butylcyclohexoxy)carbonyl-3,4,5,6-tetrachloro-benzoate Formula: C18H19Cl4NaO4 MolecularWeight: 464.14283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)OC(=O)C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)C(=O)[O-].[Na+]

Isomeric SMILES

CC(C)(C)C1CCC(CC1)OC(=O)C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)C(=O)[O-].[Na+]

InChI

InChI=1S/C18H20Cl4O4.Na/c1-18(2,3)8-4-6-9(7-5-8)26-17(25)11-10(16(23)24)12(19)14(21)15(22)13(11)20;/h8-9H,4-7H2,1-3H3,(H,23,24);/q;+1/p-1