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2-[6-fluoranyl-5-methoxy-2-methyl-1-[5-(trifluoromethylsulfanyl)thiophen-2-yl]carbonyl-indol-3-yl]ethanoic acid

2-[6-fluoranyl-5-methoxy-2-methyl-1-[5-(trifluoromethylsulfanyl)thiophen-2-yl]carbonyl-indol-3-yl]ethanoic acid

Systemtic Name:2-[6-fluoranyl-5-methoxy-2-methyl-1-[5-(trifluoromethylsulfanyl)thiophen-2-yl]carbonyl-indol-3-yl]ethanoic acid
Openeye Name:2-[6-fluoro-5-methoxy-2-methyl-1-[5-(trifluoromethylsulfanyl)thiophene-2-carbonyl]indol-3-yl]acetic acid
CAS Name:2-[6-fluoro-5-methoxy-2-methyl-1-[oxo-[5-(trifluoromethylthio)-2-thiophenyl]methyl]-3-indolyl]acetic acid
IUPAC Name:2-[6-fluoro-5-methoxy-2-methyl-1-[5-(trifluoromethylsulfanyl)thiophene-2-carbonyl]indol-3-yl]acetic acid
Traditional Name:2-[6-fluoro-5-methoxy-2-methyl-1-[5-(trifluoromethylthio)thiophene-2-carbonyl]indol-3-yl]acetic acid
Formula: C18H13F4NO4S2
MolecularWeight: 447.423733
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=C(C=C2N1C(=O)C3=CC=C(S3)SC(F)(F)F)F)OC)CC(=O)O


Isomeric SMILES

CC1=C(C2=CC(=C(C=C2N1C(=O)C3=CC=C(S3)SC(F)(F)F)F)OC)CC(=O)O


InChI

InChI=1S/C18H13F4NO4S2/c1-8-9(6-15(24)25)10-5-13(27-2)11(19)7-12(10)23(8)17(26)14-3-4-16(28-14)29-18(20,21)22/h3-5,7H,6H2,1-2H3,(H,24,25)


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