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

Systemtic Name: [3-[6-(butylamino)pyridazin-3-yl]-1H-imidazol-3-ium-2-yl]-(furan-2-yl)methanone Openeye Name: [3-[6-(butylamino)pyridazin-3-yl]-1H-imidazol-3-ium-2-yl]-(2-furyl)methanone CAS Name: [3-[6-(butylamino)-3-pyridazinyl]-1H-imidazol-3-ium-2-yl]-(2-furanyl)methanone IUPAC Name: [3-[6-(butylamino)pyridazin-3-yl]-1H-imidazol-3-ium-2-yl]-(furan-2-yl)methanone Traditional Name: [3-[6-(butylamino)pyridazin-3-yl]-1H-imidazol-3-ium-2-yl]-(2-furyl)methanone Formula: C16H18N5O2+ MolecularWeight: 312.34642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NN=C(C=C1)[N+]2=C(NC=C2)C(=O)C3=CC=CO3

Isomeric SMILES

CCCCNC1=NN=C(C=C1)[N+]2=C(NC=C2)C(=O)C3=CC=CO3

InChI

InChI=1S/C16H17N5O2/c1-2-3-8-17-13-6-7-14(20-19-13)21-10-9-18-16(21)15(22)12-5-4-11-23-12/h4-7,9-11H,2-3,8H2,1H3,(H,17,19)/p+1