3-[3-[4-(4-fluorophenyl)piperazin-1-yl]propoxy]benzoic acid

Systemtic Name: 3-[3-[4-(4-fluorophenyl)piperazin-1-yl]propoxy]benzoic acid Openeye Name: 3-[3-[4-(4-fluorophenyl)piperazin-1-yl]propoxy]benzoic acid CAS Name: 3-[3-[4-(4-fluorophenyl)-1-piperazinyl]propoxy]benzoic acid IUPAC Name: 3-[3-[4-(4-fluorophenyl)piperazin-1-yl]propoxy]benzoic acid Traditional Name: 3-[3-[4-(4-fluorophenyl)piperazino]propoxy]benzoic acid Formula: C20H23FN2O3 MolecularWeight: 358.406623

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC2=CC=CC(=C2)C(=O)O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1CCCOC2=CC=CC(=C2)C(=O)O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H23FN2O3/c21-17-5-7-18(8-6-17)23-12-10-22(11-13-23)9-2-14-26-19-4-1-3-16(15-19)20(24)25/h1,3-8,15H,2,9-14H2,(H,24,25)