[3-[6-(azepan-1-yl)pyridazin-3-yl]-1H-imidazol-3-ium-2-yl]-(furan-2-yl)methanone

Systemtic Name: [3-[6-(azepan-1-yl)pyridazin-3-yl]-1H-imidazol-3-ium-2-yl]-(furan-2-yl)methanone Openeye Name: [3-[6-(azepan-1-yl)pyridazin-3-yl]-1H-imidazol-3-ium-2-yl]-(2-furyl)methanone CAS Name: [3-[6-(1-azepanyl)-3-pyridazinyl]-1H-imidazol-3-ium-2-yl]-(2-furanyl)methanone IUPAC Name: [3-[6-(azepan-1-yl)pyridazin-3-yl]-1H-imidazol-3-ium-2-yl]-(furan-2-yl)methanone Traditional Name: [3-[6-(azepan-1-yl)pyridazin-3-yl]-1H-imidazol-3-ium-2-yl]-(2-furyl)methanone Formula: C18H20N5O2+ MolecularWeight: 338.3837

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NN=C(C=C2)[N+]3=C(NC=C3)C(=O)C4=CC=CO4

Isomeric SMILES

C1CCCN(CC1)C2=NN=C(C=C2)[N+]3=C(NC=C3)C(=O)C4=CC=CO4

InChI

InChI=1S/C18H19N5O2/c24-17(14-6-5-13-25-14)18-19-9-12-23(18)16-8-7-15(20-21-16)22-10-3-1-2-4-11-22/h5-9,12-13H,1-4,10-11H2/p+1