4-[3-[4-(4-fluorophenyl)piperazin-1-yl]carbonylpyridin-2-yl]oxybenzoic acid

Systemtic Name: 4-[3-[4-(4-fluorophenyl)piperazin-1-yl]carbonylpyridin-2-yl]oxybenzoic acid Openeye Name: 4-[[3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-pyridyl]oxy]benzoic acid CAS Name: 4-[[3-[[4-(4-fluorophenyl)-1-piperazinyl]-oxomethyl]-2-pyridinyl]oxy]benzoic acid IUPAC Name: 4-[3-[4-(4-fluorophenyl)piperazine-1-carbonyl]pyridin-2-yl]oxybenzoic acid Traditional Name: 4-[[3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-pyridyl]oxy]benzoic acid Formula: C23H20FN3O4 MolecularWeight: 421.421003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)C3=C(N=CC=C3)OC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)C3=C(N=CC=C3)OC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C23H20FN3O4/c24-17-5-7-18(8-6-17)26-12-14-27(15-13-26)22(28)20-2-1-11-25-21(20)31-19-9-3-16(4-10-19)23(29)30/h1-11H,12-15H2,(H,29,30)