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

Systemtic Name: sodium 5-[(5-chloranyl-2-propan-2-yloxy-phenyl)methyl]furan-2-carboxylate Openeye Name: sodium 5-[(5-chloro-2-isopropoxy-phenyl)methyl]furan-2-carboxylate CAS Name: sodium 5-[(5-chloro-2-propan-2-yloxyphenyl)methyl]-2-furancarboxylate IUPAC Name: sodium 5-[(5-chloro-2-propan-2-yloxyphenyl)methyl]furan-2-carboxylate Traditional Name: sodium 5-(5-chloro-2-isopropoxy-benzyl)-2-furoate Formula: C15H14ClNaO4 MolecularWeight: 316.71203

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)Cl)CC2=CC=C(O2)C(=O)[O-].[Na+]

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)Cl)CC2=CC=C(O2)C(=O)[O-].[Na+]

InChI

InChI=1S/C15H15ClO4.Na/c1-9(2)19-13-5-3-11(16)7-10(13)8-12-4-6-14(20-12)15(17)18;/h3-7,9H,8H2,1-2H3,(H,17,18);/q;+1/p-1