5-acetamido-2-[4-(4-fluorophenyl)piperazin-1-yl]benzoic acid

Systemtic Name: 5-acetamido-2-[4-(4-fluorophenyl)piperazin-1-yl]benzoic acid Openeye Name: 5-acetamido-2-[4-(4-fluorophenyl)piperazin-1-yl]benzoic acid CAS Name: 5-acetamido-2-[4-(4-fluorophenyl)-1-piperazinyl]benzoic acid IUPAC Name: 5-acetamido-2-[4-(4-fluorophenyl)piperazin-1-yl]benzoic acid Traditional Name: 5-acetamido-2-[4-(4-fluorophenyl)piperazino]benzoic acid Formula: C19H20FN3O3 MolecularWeight: 357.378803

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=C(C=C3)F)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=C(C=C3)F)C(=O)O

InChI

InChI=1S/C19H20FN3O3/c1-13(24)21-15-4-7-18(17(12-15)19(25)26)23-10-8-22(9-11-23)16-5-2-14(20)3-6-16/h2-7,12H,8-11H2,1H3,(H,21,24)(H,25,26)