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

Systemtic Name: 3-[5-[[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]methoxy]-1H-indol-2-yl]propanoic acid Openeye Name: 3-[5-[[4-phenyl-5-(trifluoromethyl)-2-thienyl]methoxy]-1H-indol-2-yl]propanoic acid CAS Name: 3-[5-[[4-phenyl-5-(trifluoromethyl)-2-thiophenyl]methoxy]-1H-indol-2-yl]propanoic acid IUPAC Name: 3-[5-[[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]methoxy]-1H-indol-2-yl]propanoic acid Traditional Name: 3-[5-[[4-phenyl-5-(trifluoromethyl)-2-thienyl]methoxy]-1H-indol-2-yl]propionic acid Formula: C23H18F3NO3S MolecularWeight: 445.45413

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(SC(=C2)COC3=CC4=C(C=C3)NC(=C4)CCC(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=C(SC(=C2)COC3=CC4=C(C=C3)NC(=C4)CCC(=O)O)C(F)(F)F

InChI

InChI=1S/C23H18F3NO3S/c24-23(25,26)22-19(14-4-2-1-3-5-14)12-18(31-22)13-30-17-7-8-20-15(11-17)10-16(27-20)6-9-21(28)29/h1-5,7-8,10-12,27H,6,9,13H2,(H,28,29)