4-[4-[5-(4-fluorophenyl)-3-piperidin-4-yl-imidazol-4-yl]pyrimidin-2-yl]oxybenzoic acid

Systemtic Name: 4-[4-[5-(4-fluorophenyl)-3-piperidin-4-yl-imidazol-4-yl]pyrimidin-2-yl]oxybenzoic acid Openeye Name: 4-[4-[5-(4-fluorophenyl)-3-(4-piperidyl)imidazol-4-yl]pyrimidin-2-yl]oxybenzoic acid CAS Name: 4-[[4-[5-(4-fluorophenyl)-3-(4-piperidinyl)-4-imidazolyl]-2-pyrimidinyl]oxy]benzoic acid IUPAC Name: 4-[4-[5-(4-fluorophenyl)-3-piperidin-4-ylimidazol-4-yl]pyrimidin-2-yl]oxybenzoic acid Traditional Name: 4-[4-[5-(4-fluorophenyl)-3-(4-piperidyl)imidazol-4-yl]pyrimidin-2-yl]oxybenzoic acid Formula: C25H22FN5O3 MolecularWeight: 459.472283

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1N2C=NC(=C2C3=NC(=NC=C3)OC4=CC=C(C=C4)C(=O)O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CNCCC1N2C=NC(=C2C3=NC(=NC=C3)OC4=CC=C(C=C4)C(=O)O)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H22FN5O3/c26-18-5-1-16(2-6-18)22-23(31(15-29-22)19-9-12-27-13-10-19)21-11-14-28-25(30-21)34-20-7-3-17(4-8-20)24(32)33/h1-8,11,14-15,19,27H,9-10,12-13H2,(H,32,33)