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

Systemtic Name: 3-[4-(2-chloranyl-6-fluoranyl-phenyl)carbonylpiperazin-1-yl]propanoic acid Openeye Name: 3-[4-(2-chloro-6-fluoro-benzoyl)piperazin-1-yl]propanoic acid CAS Name: 3-[4-[(2-chloro-6-fluorophenyl)-oxomethyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-(2-chloro-6-fluorobenzoyl)piperazin-1-yl]propanoic acid Traditional Name: 3-[4-(2-chloro-6-fluoro-benzoyl)piperazino]propionic acid Formula: C14H16ClFN2O3 MolecularWeight: 314.739843

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)O)C(=O)C2=C(C=CC=C2Cl)F

Isomeric SMILES

C1CN(CCN1CCC(=O)O)C(=O)C2=C(C=CC=C2Cl)F

InChI

InChI=1S/C14H16ClFN2O3/c15-10-2-1-3-11(16)13(10)14(21)18-8-6-17(7-9-18)5-4-12(19)20/h1-3H,4-9H2,(H,19,20)