sodium 5-[[5-chloranyl-2-(cyclohexylmethoxy)phenyl]methyl]furan-2-carboxylate

Systemtic Name: sodium 5-[[5-chloranyl-2-(cyclohexylmethoxy)phenyl]methyl]furan-2-carboxylate Openeye Name: sodium 5-[[5-chloro-2-(cyclohexylmethoxy)phenyl]methyl]furan-2-carboxylate CAS Name: sodium 5-[[5-chloro-2-(cyclohexylmethoxy)phenyl]methyl]-2-furancarboxylate IUPAC Name: sodium 5-[[5-chloro-2-(cyclohexylmethoxy)phenyl]methyl]furan-2-carboxylate Traditional Name: sodium 5-[5-chloro-2-(cyclohexylmethoxy)benzyl]-2-furoate Formula: C19H20ClNaO4 MolecularWeight: 370.80247

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)COC2=C(C=C(C=C2)Cl)CC3=CC=C(O3)C(=O)[O-].[Na+]

Isomeric SMILES

C1CCC(CC1)COC2=C(C=C(C=C2)Cl)CC3=CC=C(O3)C(=O)[O-].[Na+]

InChI

InChI=1S/C19H21ClO4.Na/c20-15-6-8-17(23-12-13-4-2-1-3-5-13)14(10-15)11-16-7-9-18(24-16)19(21)22;/h6-10,13H,1-5,11-12H2,(H,21,22);/q;+1/p-1