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

Systemtic Name: 2-(3-butylsulfonyl-5-fluoranyl-2-methyl-indol-1-yl)ethanoic acid Openeye Name: 2-(3-butylsulfonyl-5-fluoro-2-methyl-indol-1-yl)acetic acid CAS Name: 2-(3-butylsulfonyl-5-fluoro-2-methyl-1-indolyl)acetic acid IUPAC Name: 2-(3-butylsulfonyl-5-fluoro-2-methylindol-1-yl)acetic acid Traditional Name: 2-(3-butylsulfonyl-5-fluoro-2-methyl-indol-1-yl)acetic acid Formula: C15H18FNO4S MolecularWeight: 327.371123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)C1=C(N(C2=C1C=C(C=C2)F)CC(=O)O)C

Isomeric SMILES

CCCCS(=O)(=O)C1=C(N(C2=C1C=C(C=C2)F)CC(=O)O)C

InChI

InChI=1S/C15H18FNO4S/c1-3-4-7-22(20,21)15-10(2)17(9-14(18)19)13-6-5-11(16)8-12(13)15/h5-6,8H,3-4,7,9H2,1-2H3,(H,18,19)