3-[5-thiophen-2-yl-1-[3-(trifluoromethyl)phenyl]pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[5-thiophen-2-yl-1-[3-(trifluoromethyl)phenyl]pyrrol-2-yl]propanoic acid Openeye Name: 3-[5-(2-thienyl)-1-[3-(trifluoromethyl)phenyl]pyrrol-2-yl]propanoic acid CAS Name: 3-[5-thiophen-2-yl-1-[3-(trifluoromethyl)phenyl]-2-pyrrolyl]propanoic acid IUPAC Name: 3-[5-thiophen-2-yl-1-[3-(trifluoromethyl)phenyl]pyrrol-2-yl]propanoic acid Traditional Name: 3-[5-(2-thienyl)-1-[3-(trifluoromethyl)phenyl]pyrrol-2-yl]propionic acid Formula: C18H14F3NO2S MolecularWeight: 365.36947

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C(=CC=C2C3=CC=CS3)CCC(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)N2C(=CC=C2C3=CC=CS3)CCC(=O)O)C(F)(F)F

InChI

InChI=1S/C18H14F3NO2S/c19-18(20,21)12-3-1-4-14(11-12)22-13(7-9-17(23)24)6-8-15(22)16-5-2-10-25-16/h1-6,8,10-11H,7,9H2,(H,23,24)