3-fluoranyl-4-[4-(4-hydroxyphenyl)piperazin-1-yl]benzoic acid

Systemtic Name: 3-fluoranyl-4-[4-(4-hydroxyphenyl)piperazin-1-yl]benzoic acid Openeye Name: 3-fluoro-4-[4-(4-hydroxyphenyl)piperazin-1-yl]benzoic acid CAS Name: 3-fluoro-4-[4-(4-hydroxyphenyl)-1-piperazinyl]benzoic acid IUPAC Name: 3-fluoro-4-[4-(4-hydroxyphenyl)piperazin-1-yl]benzoic acid Traditional Name: 3-fluoro-4-[4-(4-hydroxyphenyl)piperazino]benzoic acid Formula: C17H17FN2O3 MolecularWeight: 316.326883

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)O)C3=C(C=C(C=C3)C(=O)O)F

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)O)C3=C(C=C(C=C3)C(=O)O)F

InChI

InChI=1S/C17H17FN2O3/c18-15-11-12(17(22)23)1-6-16(15)20-9-7-19(8-10-20)13-2-4-14(21)5-3-13/h1-6,11,21H,7-10H2,(H,22,23)