sodium 2-cyclohexyl-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: sodium 2-cyclohexyl-2-oxidanyl-2-phenyl-ethanoate Openeye Name: sodium 2-cyclohexyl-2-hydroxy-2-phenyl-acetate CAS Name: sodium 2-cyclohexyl-2-hydroxy-2-phenylacetate IUPAC Name: sodium 2-cyclohexyl-2-hydroxy-2-phenylacetate Traditional Name: sodium 2-cyclohexyl-2-hydroxy-2-phenyl-acetate Formula: C14H17NaO3 MolecularWeight: 256.27275

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18O3.Na/c15-13(16)14(17,11-7-3-1-4-8-11)12-9-5-2-6-10-12;/h1,3-4,7-8,12,17H,2,5-6,9-10H2,(H,15,16);/q;+1/p-1