(E)-3-[4-(4-ethylpiperazin-4-ium-1-yl)-3-fluoranyl-phenyl]prop-2-enoate

Systemtic Name: (E)-3-[4-(4-ethylpiperazin-4-ium-1-yl)-3-fluoranyl-phenyl]prop-2-enoate Openeye Name: (E)-3-[4-(4-ethylpiperazin-4-ium-1-yl)-3-fluoro-phenyl]prop-2-enoate CAS Name: (E)-3-[4-(4-ethyl-1-piperazin-4-iumyl)-3-fluorophenyl]-2-propenoate IUPAC Name: (E)-3-[4-(4-ethylpiperazin-4-ium-1-yl)-3-fluorophenyl]prop-2-enoate Traditional Name: (E)-3-[4-(4-ethylpiperazin-4-ium-1-yl)-3-fluoro-phenyl]acrylate Formula: C15H19FN2O2 MolecularWeight: 278.321963

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)C=CC(=O)[O-])F

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)/C=C/C(=O)[O-])F

InChI

InChI=1S/C15H19FN2O2/c1-2-17-7-9-18(10-8-17)14-5-3-12(11-13(14)16)4-6-15(19)20/h3-6,11H,2,7-10H2,1H3,(H,19,20)/b6-4+