3-[[6,8-bis(fluoranyl)-3,4-dihydro-2H-quinolin-1-yl]sulfonyl]benzoic acid

Systemtic Name: 3-[[6,8-bis(fluoranyl)-3,4-dihydro-2H-quinolin-1-yl]sulfonyl]benzoic acid Openeye Name: 3-[(6,8-difluoro-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzoic acid CAS Name: 3-[(6,8-difluoro-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzoic acid IUPAC Name: 3-[(6,8-difluoro-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzoic acid Traditional Name: 3-[(6,8-difluoro-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzoic acid Formula: C16H13F2NO4S MolecularWeight: 353.340526

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC(=CC(=C2N(C1)S(=O)(=O)C3=CC=CC(=C3)C(=O)O)F)F

Isomeric SMILES

C1CC2=CC(=CC(=C2N(C1)S(=O)(=O)C3=CC=CC(=C3)C(=O)O)F)F

InChI

InChI=1S/C16H13F2NO4S/c17-12-7-10-4-2-6-19(15(10)14(18)9-12)24(22,23)13-5-1-3-11(8-13)16(20)21/h1,3,5,7-9H,2,4,6H2,(H,20,21)