2-[5-fluoranyl-2-methyl-1-[4-(3-methylphenoxy)phenyl]sulfonyl-indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-fluoranyl-2-methyl-1-[4-(3-methylphenoxy)phenyl]sulfonyl-indol-3-yl]ethanoic acid Openeye Name: 2-[5-fluoro-2-methyl-1-[4-(3-methylphenoxy)phenyl]sulfonyl-indol-3-yl]acetic acid CAS Name: 2-[5-fluoro-2-methyl-1-[4-(3-methylphenoxy)phenyl]sulfonyl-3-indolyl]acetic acid IUPAC Name: 2-[5-fluoro-2-methyl-1-[4-(3-methylphenoxy)phenyl]sulfonylindol-3-yl]acetic acid Traditional Name: 2-[5-fluoro-2-methyl-1-[4-(3-methylphenoxy)phenyl]sulfonyl-indol-3-yl]acetic acid Formula: C24H20FNO5S MolecularWeight: 453.482703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC=C(C=C2)S(=O)(=O)N3C(=C(C4=C3C=CC(=C4)F)CC(=O)O)C

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC=C(C=C2)S(=O)(=O)N3C(=C(C4=C3C=CC(=C4)F)CC(=O)O)C

InChI

InChI=1S/C24H20FNO5S/c1-15-4-3-5-19(12-15)31-18-7-9-20(10-8-18)32(29,30)26-16(2)21(14-24(27)28)22-13-17(25)6-11-23(22)26/h3-13H,14H2,1-2H3,(H,27,28)