2-[2-[1-(6-chloranylpyridazin-3-yl)piperidin-1-ium-1-yl]ethoxy]benzaldehyde

Systemtic Name: 2-[2-[1-(6-chloranylpyridazin-3-yl)piperidin-1-ium-1-yl]ethoxy]benzaldehyde Openeye Name: 2-[2-[1-(6-chloropyridazin-3-yl)piperidin-1-ium-1-yl]ethoxy]benzaldehyde CAS Name: 2-[2-[1-(6-chloro-3-pyridazinyl)-1-piperidin-1-iumyl]ethoxy]benzaldehyde IUPAC Name: 2-[2-[1-(6-chloropyridazin-3-yl)piperidin-1-ium-1-yl]ethoxy]benzaldehyde Traditional Name: 2-[2-[1-(6-chloropyridazin-3-yl)piperidin-1-ium-1-yl]ethoxy]benzaldehyde Formula: C18H21ClN3O2+ MolecularWeight: 346.83124

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](CC1)(CCOC2=CC=CC=C2C=O)C3=NN=C(C=C3)Cl

Isomeric SMILES

C1CC[N+](CC1)(CCOC2=CC=CC=C2C=O)C3=NN=C(C=C3)Cl

InChI

InChI=1S/C18H21ClN3O2/c19-17-8-9-18(21-20-17)22(10-4-1-5-11-22)12-13-24-16-7-3-2-6-15(16)14-23/h2-3,6-9,14H,1,4-5,10-13H2/q+1