4-[3-(4-ethoxycarbonyl-2-fluoranyl-phenoxy)propyl]piperazine-1-carboxylic acid

Systemtic Name: 4-[3-(4-ethoxycarbonyl-2-fluoranyl-phenoxy)propyl]piperazine-1-carboxylic acid Openeye Name: 4-[3-(4-ethoxycarbonyl-2-fluoro-phenoxy)propyl]piperazine-1-carboxylic acid CAS Name: 4-[3-(4-ethoxycarbonyl-2-fluorophenoxy)propyl]-1-piperazinecarboxylic acid IUPAC Name: 4-[3-(4-ethoxycarbonyl-2-fluorophenoxy)propyl]piperazine-1-carboxylic acid Traditional Name: 4-[3-(4-carbethoxy-2-fluoro-phenoxy)propyl]piperazine-1-carboxylic acid Formula: C17H23FN2O5 MolecularWeight: 354.373323

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)OCCCN2CCN(CC2)C(=O)O)F

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)OCCCN2CCN(CC2)C(=O)O)F

InChI

InChI=1S/C17H23FN2O5/c1-2-24-16(21)13-4-5-15(14(18)12-13)25-11-3-6-19-7-9-20(10-8-19)17(22)23/h4-5,12H,2-3,6-11H2,1H3,(H,22,23)