4-[(4-aminocarbonyl-2-fluoranyl-phenyl)methylsulfanyl]benzoate

Systemtic Name: 4-[(4-aminocarbonyl-2-fluoranyl-phenyl)methylsulfanyl]benzoate Openeye Name: 4-[(4-carbamoyl-2-fluoro-phenyl)methylsulfanyl]benzoate CAS Name: 4-[(4-carbamoyl-2-fluorophenyl)methylthio]benzoate IUPAC Name: 4-[(4-carbamoyl-2-fluorophenyl)methylsulfanyl]benzoate Traditional Name: 4-[(4-carbamoyl-2-fluoro-benzyl)thio]benzoate Formula: C15H11FNO3S- MolecularWeight: 304.316143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)[O-])SCC2=C(C=C(C=C2)C(=O)N)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)[O-])SCC2=C(C=C(C=C2)C(=O)N)F

InChI

InChI=1S/C15H12FNO3S/c16-13-7-10(14(17)18)1-2-11(13)8-21-12-5-3-9(4-6-12)15(19)20/h1-7H,8H2,(H2,17,18)(H,19,20)/p-1