sodium 3-[3-(5-chloranyl-2-phenylmethoxy-phenyl)thiophen-2-yl]-4-fluoranyl-benzoate

Systemtic Name: sodium 3-[3-(5-chloranyl-2-phenylmethoxy-phenyl)thiophen-2-yl]-4-fluoranyl-benzoate Openeye Name: sodium 3-[3-(2-benzyloxy-5-chloro-phenyl)-2-thienyl]-4-fluoro-benzoate CAS Name: sodium 3-[3-(5-chloro-2-phenylmethoxyphenyl)-2-thiophenyl]-4-fluorobenzoate IUPAC Name: sodium 3-[3-(5-chloro-2-phenylmethoxyphenyl)thiophen-2-yl]-4-fluorobenzoate Traditional Name: sodium 3-[3-(2-benzoxy-5-chloro-phenyl)-2-thienyl]-4-fluoro-benzoate Formula: C24H15ClFNaO3S MolecularWeight: 460.880273

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)C3=C(SC=C3)C4=C(C=CC(=C4)C(=O)[O-])F.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)C3=C(SC=C3)C4=C(C=CC(=C4)C(=O)[O-])F.[Na+]

InChI

InChI=1S/C24H16ClFO3S.Na/c25-17-7-9-22(29-14-15-4-2-1-3-5-15)19(13-17)18-10-11-30-23(18)20-12-16(24(27)28)6-8-21(20)26;/h1-13H,14H2,(H,27,28);/q;+1/p-1