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

Systemtic Name: 2-[1-[4-(dimethylcarbamoyl)phenyl]sulfonyl-5-fluoranyl-2-methyl-indol-3-yl]ethanoic acid Openeye Name: 2-[1-[4-(dimethylcarbamoyl)phenyl]sulfonyl-5-fluoro-2-methyl-indol-3-yl]acetic acid CAS Name: 2-[1-[4-[dimethylamino(oxo)methyl]phenyl]sulfonyl-5-fluoro-2-methyl-3-indolyl]acetic acid IUPAC Name: 2-[1-[4-(dimethylcarbamoyl)phenyl]sulfonyl-5-fluoro-2-methylindol-3-yl]acetic acid Traditional Name: 2-[1-[4-(dimethylcarbamoyl)phenyl]sulfonyl-5-fluoro-2-methyl-indol-3-yl]acetic acid Formula: C20H19FN2O5S MolecularWeight: 418.438663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1S(=O)(=O)C3=CC=C(C=C3)C(=O)N(C)C)C=CC(=C2)F)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1S(=O)(=O)C3=CC=C(C=C3)C(=O)N(C)C)C=CC(=C2)F)CC(=O)O

InChI

InChI=1S/C20H19FN2O5S/c1-12-16(11-19(24)25)17-10-14(21)6-9-18(17)23(12)29(27,28)15-7-4-13(5-8-15)20(26)22(2)3/h4-10H,11H2,1-3H3,(H,24,25)