2-[(4-fluorophenyl)methylsulfinyl]quinoline-3-carboxylic acid

Systemtic Name: 2-[(4-fluorophenyl)methylsulfinyl]quinoline-3-carboxylic acid Openeye Name: 2-[(4-fluorophenyl)methylsulfinyl]quinoline-3-carboxylic acid CAS Name: 2-[(4-fluorophenyl)methylsulfinyl]-3-quinolinecarboxylic acid IUPAC Name: 2-[(4-fluorophenyl)methylsulfinyl]quinoline-3-carboxylic acid Traditional Name: 2-(4-fluorobenzyl)sulfinylquinoline-3-carboxylic acid Formula: C17H12FNO3S MolecularWeight: 329.345483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=N2)S(=O)CC3=CC=C(C=C3)F)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=N2)S(=O)CC3=CC=C(C=C3)F)C(=O)O

InChI

InChI=1S/C17H12FNO3S/c18-13-7-5-11(6-8-13)10-23(22)16-14(17(20)21)9-12-3-1-2-4-15(12)19-16/h1-9H,10H2,(H,20,21)