2-[3-(carboxymethylsulfonyl)-5-fluoranyl-2-methyl-indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-(carboxymethylsulfonyl)-5-fluoranyl-2-methyl-indol-1-yl]ethanoic acid Openeye Name: 2-[3-(carboxymethylsulfonyl)-5-fluoro-2-methyl-indol-1-yl]acetic acid CAS Name: 2-[3-(carboxymethylsulfonyl)-5-fluoro-2-methyl-1-indolyl]acetic acid IUPAC Name: 2-[3-(carboxymethylsulfonyl)-5-fluoro-2-methylindol-1-yl]acetic acid Traditional Name: 2-[3-(carboxymethylsulfonyl)-5-fluoro-2-methyl-indol-1-yl]acetic acid Formula: C13H12FNO6S MolecularWeight: 329.300883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC(=O)O)C=CC(=C2)F)S(=O)(=O)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1CC(=O)O)C=CC(=C2)F)S(=O)(=O)CC(=O)O

InChI

InChI=1S/C13H12FNO6S/c1-7-13(22(20,21)6-12(18)19)9-4-8(14)2-3-10(9)15(7)5-11(16)17/h2-4H,5-6H2,1H3,(H,16,17)(H,18,19)