1-[[1-(6-chloranylpyridazin-3-yl)imidazol-2-yl]-methyl-phosphoryl]azepane

Systemtic Name: 1-[[1-(6-chloranylpyridazin-3-yl)imidazol-2-yl]-methyl-phosphoryl]azepane Openeye Name: 1-[[1-(6-chloropyridazin-3-yl)imidazol-2-yl]-methyl-phosphoryl]azepane CAS Name: 1-[[1-(6-chloro-3-pyridazinyl)-2-imidazolyl]-methylphosphoryl]azepane IUPAC Name: 1-[[1-(6-chloropyridazin-3-yl)imidazol-2-yl]-methylphosphoryl]azepane Traditional Name: 1-[[1-(6-chloropyridazin-3-yl)imidazol-2-yl]-methyl-phosphoryl]azepane Formula: C14H19ClN5OP MolecularWeight: 339.760321

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Descriptors Computed from Structure

Canonical SMILES:

CP(=O)(C1=NC=CN1C2=NN=C(C=C2)Cl)N3CCCCCC3

Isomeric SMILES

C[P@@](=O)(C1=NC=CN1C2=NN=C(C=C2)Cl)N3CCCCCC3

InChI

InChI=1S/C14H19ClN5OP/c1-22(21,19-9-4-2-3-5-10-19)14-16-8-11-20(14)13-7-6-12(15)17-18-13/h6-8,11H,2-5,9-10H2,1H3/t22-/m1/s1