3-[1-methyl-5-[[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]methoxy]indol-2-yl]propanoic acid

Systemtic Name: 3-[1-methyl-5-[[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]methoxy]indol-2-yl]propanoic acid Openeye Name: 3-[1-methyl-5-[[4-phenyl-5-(trifluoromethyl)-2-thienyl]methoxy]indol-2-yl]propanoic acid CAS Name: 3-[1-methyl-5-[[4-phenyl-5-(trifluoromethyl)-2-thiophenyl]methoxy]-2-indolyl]propanoic acid IUPAC Name: 3-[1-methyl-5-[[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]methoxy]indol-2-yl]propanoic acid Traditional Name: 3-[1-methyl-5-[[4-phenyl-5-(trifluoromethyl)-2-thienyl]methoxy]indol-2-yl]propionic acid Formula: C24H20F3NO3S MolecularWeight: 459.48071

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)OCC3=CC(=C(S3)C(F)(F)F)C4=CC=CC=C4)C=C1CCC(=O)O

Isomeric SMILES

CN1C2=C(C=C(C=C2)OCC3=CC(=C(S3)C(F)(F)F)C4=CC=CC=C4)C=C1CCC(=O)O

InChI

InChI=1S/C24H20F3NO3S/c1-28-17(7-10-22(29)30)11-16-12-18(8-9-21(16)28)31-14-19-13-20(15-5-3-2-4-6-15)23(32-19)24(25,26)27/h2-6,8-9,11-13H,7,10,14H2,1H3,(H,29,30)