2,4,5-tris(chloranyl)-6-[4-(furan-2-ylcarbonyl)piperazin-1-yl]pyridin-1-ium-3-carbonitrile

Systemtic Name: 2,4,5-tris(chloranyl)-6-[4-(furan-2-ylcarbonyl)piperazin-1-yl]pyridin-1-ium-3-carbonitrile Openeye Name: 2,4,5-trichloro-6-[4-(furan-2-carbonyl)piperazin-1-yl]pyridin-1-ium-3-carbonitrile CAS Name: 2,4,5-trichloro-6-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-3-pyridin-1-iumcarbonitrile IUPAC Name: 2,4,5-trichloro-6-[4-(furan-2-carbonyl)piperazin-1-yl]pyridin-1-ium-3-carbonitrile Traditional Name: 2,4,5-trichloro-6-[4-(2-furoyl)piperazino]pyridin-1-ium-3-carbonitrile Formula: C15H12Cl3N4O2+ MolecularWeight: 386.64038

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=C(C(=[NH+]2)Cl)C#N)Cl)Cl)C(=O)C3=CC=CO3

Isomeric SMILES

C1CN(CCN1C2=C(C(=C(C(=[NH+]2)Cl)C#N)Cl)Cl)C(=O)C3=CC=CO3

InChI

InChI=1S/C15H11Cl3N4O2/c16-11-9(8-19)13(18)20-14(12(11)17)21-3-5-22(6-4-21)15(23)10-2-1-7-24-10/h1-2,7H,3-6H2/p+1