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

Systemtic Name: 2-[5-fluoranyl-2-methyl-1-(4-methylnaphthalen-1-yl)sulfonyl-indol-3-yl]ethanoic acid Openeye Name: 2-[5-fluoro-2-methyl-1-[(4-methyl-1-naphthyl)sulfonyl]indol-3-yl]acetic acid CAS Name: 2-[5-fluoro-2-methyl-1-[(4-methyl-1-naphthalenyl)sulfonyl]-3-indolyl]acetic acid IUPAC Name: 2-[5-fluoro-2-methyl-1-(4-methylnaphthalen-1-yl)sulfonylindol-3-yl]acetic acid Traditional Name: 2-[5-fluoro-2-methyl-1-[(4-methyl-1-naphthyl)sulfonyl]indol-3-yl]acetic acid Formula: C22H18FNO4S MolecularWeight: 411.446023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C2=CC=CC=C12)S(=O)(=O)N3C(=C(C4=C3C=CC(=C4)F)CC(=O)O)C

Isomeric SMILES

CC1=CC=C(C2=CC=CC=C12)S(=O)(=O)N3C(=C(C4=C3C=CC(=C4)F)CC(=O)O)C

InChI

InChI=1S/C22H18FNO4S/c1-13-7-10-21(17-6-4-3-5-16(13)17)29(27,28)24-14(2)18(12-22(25)26)19-11-15(23)8-9-20(19)24/h3-11H,12H2,1-2H3,(H,25,26)