3-[1-(4-dimethylaminophenyl)-5-(4-fluorophenyl)pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[1-(4-dimethylaminophenyl)-5-(4-fluorophenyl)pyrrol-2-yl]propanoic acid Openeye Name: 3-[1-(4-dimethylaminophenyl)-5-(4-fluorophenyl)pyrrol-2-yl]propanoic acid CAS Name: 3-[1-(4-dimethylaminophenyl)-5-(4-fluorophenyl)-2-pyrrolyl]propanoic acid IUPAC Name: 3-[1-(4-dimethylaminophenyl)-5-(4-fluorophenyl)pyrrol-2-yl]propanoic acid Traditional Name: 3-[1-(4-dimethylaminophenyl)-5-(4-fluorophenyl)pyrrol-2-yl]propionic acid Formula: C21H21FN2O2 MolecularWeight: 352.402043

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)N2C(=CC=C2C3=CC=C(C=C3)F)CCC(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)N2C(=CC=C2C3=CC=C(C=C3)F)CCC(=O)O

InChI

InChI=1S/C21H21FN2O2/c1-23(2)17-7-9-18(10-8-17)24-19(12-14-21(25)26)11-13-20(24)15-3-5-16(22)6-4-15/h3-11,13H,12,14H2,1-2H3,(H,25,26)