3-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]propanoic acid CAS Name: 3-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-(3-fluoro-4-methoxy-benzyl)piperazino]propionic acid Formula: C15H21FN2O3 MolecularWeight: 296.337243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)CCC(=O)O)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)CCC(=O)O)F

InChI

InChI=1S/C15H21FN2O3/c1-21-14-3-2-12(10-13(14)16)11-18-8-6-17(7-9-18)5-4-15(19)20/h2-3,10H,4-9,11H2,1H3,(H,19,20)