4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine-1-carbaldehyde

Systemtic Name: 4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine-1-carbaldehyde Openeye Name: 4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine-1-carbaldehyde CAS Name: 4-[5-(trifluoromethyl)-2-pyridin-1-iumyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine-1-carbaldehyde Traditional Name: 4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine-1-carbaldehyde Formula: C11H13F3N3O+ MolecularWeight: 260.23563

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)C2=[NH+]C=C(C=C2)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C=O)C2=[NH+]C=C(C=C2)C(F)(F)F

InChI

InChI=1S/C11H12F3N3O/c12-11(13,14)9-1-2-10(15-7-9)17-5-3-16(8-18)4-6-17/h1-2,7-8H,3-6H2/p+1