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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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