2-(1-ethylsulfonyl-5-fluoranyl-2-methyl-indol-3-yl)ethanoic acid

Systemtic Name: 2-(1-ethylsulfonyl-5-fluoranyl-2-methyl-indol-3-yl)ethanoic acid Openeye Name: 2-(1-ethylsulfonyl-5-fluoro-2-methyl-indol-3-yl)acetic acid CAS Name: 2-(1-ethylsulfonyl-5-fluoro-2-methyl-3-indolyl)acetic acid IUPAC Name: 2-(1-ethylsulfonyl-5-fluoro-2-methylindol-3-yl)acetic acid Traditional Name: 2-(1-esyl-5-fluoro-2-methyl-indol-3-yl)acetic acid Formula: C13H14FNO4S MolecularWeight: 299.317963

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1C(=C(C2=C1C=CC(=C2)F)CC(=O)O)C

Isomeric SMILES

CCS(=O)(=O)N1C(=C(C2=C1C=CC(=C2)F)CC(=O)O)C

InChI

InChI=1S/C13H14FNO4S/c1-3-20(18,19)15-8(2)10(7-13(16)17)11-6-9(14)4-5-12(11)15/h4-6H,3,7H2,1-2H3,(H,16,17)