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

Systemtic Name: 3-[1-ethyl-5-[[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]methoxy]indol-2-yl]propanoic acid Openeye Name: 3-[1-ethyl-5-[[4-phenyl-5-(trifluoromethyl)-2-thienyl]methoxy]indol-2-yl]propanoic acid CAS Name: 3-[1-ethyl-5-[[4-phenyl-5-(trifluoromethyl)-2-thiophenyl]methoxy]-2-indolyl]propanoic acid IUPAC Name: 3-[1-ethyl-5-[[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]methoxy]indol-2-yl]propanoic acid Traditional Name: 3-[1-ethyl-5-[[4-phenyl-5-(trifluoromethyl)-2-thienyl]methoxy]indol-2-yl]propionic acid Formula: C25H22F3NO3S MolecularWeight: 473.50729

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)OCC3=CC(=C(S3)C(F)(F)F)C4=CC=CC=C4)C=C1CCC(=O)O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)OCC3=CC(=C(S3)C(F)(F)F)C4=CC=CC=C4)C=C1CCC(=O)O

InChI

InChI=1S/C25H22F3NO3S/c1-2-29-18(8-11-23(30)31)12-17-13-19(9-10-22(17)29)32-15-20-14-21(16-6-4-3-5-7-16)24(33-20)25(26,27)28/h3-7,9-10,12-14H,2,8,11,15H2,1H3,(H,30,31)