5-fluoranyl-2-[(3-nitrophenyl)methylsulfinyl]benzoic acid

Systemtic Name: 5-fluoranyl-2-[(3-nitrophenyl)methylsulfinyl]benzoic acid Openeye Name: 5-fluoro-2-[(3-nitrophenyl)methylsulfinyl]benzoic acid CAS Name: 5-fluoro-2-[(3-nitrophenyl)methylsulfinyl]benzoic acid IUPAC Name: 5-fluoro-2-[(3-nitrophenyl)methylsulfinyl]benzoic acid Traditional Name: 5-fluoro-2-(3-nitrobenzyl)sulfinyl-benzoic acid Formula: C14H10FNO5S MolecularWeight: 323.296303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CS(=O)C2=C(C=C(C=C2)F)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CS(=O)C2=C(C=C(C=C2)F)C(=O)O

InChI

InChI=1S/C14H10FNO5S/c15-10-4-5-13(12(7-10)14(17)18)22(21)8-9-2-1-3-11(6-9)16(19)20/h1-7H,8H2,(H,17,18)