3-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-[(2-chloro-6-fluoro-phenyl)methyl]piperazin-1-yl]propanoic acid CAS Name: 3-[4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-(2-chloro-6-fluoro-benzyl)piperazino]propionic acid Formula: C14H18ClFN2O2 MolecularWeight: 300.756323

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)O)CC2=C(C=CC=C2Cl)F

Isomeric SMILES

C1CN(CCN1CCC(=O)O)CC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C14H18ClFN2O2/c15-12-2-1-3-13(16)11(12)10-18-8-6-17(7-9-18)5-4-14(19)20/h1-3H,4-10H2,(H,19,20)