4-[2-[2-[(5-fluoranyl-2-methyl-phenyl)sulfonylamino]phenyl]ethyl]benzoic acid

Systemtic Name: 4-[2-[2-[(5-fluoranyl-2-methyl-phenyl)sulfonylamino]phenyl]ethyl]benzoic acid Openeye Name: 4-[2-[2-[(5-fluoro-2-methyl-phenyl)sulfonylamino]phenyl]ethyl]benzoic acid CAS Name: 4-[2-[2-[(5-fluoro-2-methylphenyl)sulfonylamino]phenyl]ethyl]benzoic acid IUPAC Name: 4-[2-[2-[(5-fluoro-2-methylphenyl)sulfonylamino]phenyl]ethyl]benzoic acid Traditional Name: 4-[2-[2-[(5-fluoro-2-methyl-phenyl)sulfonylamino]phenyl]ethyl]benzoic acid Formula: C22H20FNO4S MolecularWeight: 413.461903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)S(=O)(=O)NC2=CC=CC=C2CCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)F)S(=O)(=O)NC2=CC=CC=C2CCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C22H20FNO4S/c1-15-6-13-19(23)14-21(15)29(27,28)24-20-5-3-2-4-17(20)10-7-16-8-11-18(12-9-16)22(25)26/h2-6,8-9,11-14,24H,7,10H2,1H3,(H,25,26)