2-(4-ethylpiperazin-4-ium-1-yl)-6-fluoranyl-quinoline-3-carbaldehyde

Systemtic Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-fluoranyl-quinoline-3-carbaldehyde Openeye Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-fluoro-quinoline-3-carbaldehyde CAS Name: 2-(4-ethyl-1-piperazin-4-iumyl)-6-fluoro-3-quinolinecarboxaldehyde IUPAC Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-fluoroquinoline-3-carbaldehyde Traditional Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-fluoro-quinoline-3-carbaldehyde Formula: C16H19FN3O+ MolecularWeight: 288.339963

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C3C=C(C=CC3=N2)F)C=O

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C3C=C(C=CC3=N2)F)C=O

InChI

InChI=1S/C16H18FN3O/c1-2-19-5-7-20(8-6-19)16-13(11-21)9-12-10-14(17)3-4-15(12)18-16/h3-4,9-11H,2,5-8H2,1H3/p+1