5-(chloromethyl)-1-methyl-4H-pyrazolo[1,5-a]pyrimidin-1-ium-7-one

Systemtic Name: 5-(chloromethyl)-1-methyl-4H-pyrazolo[1,5-a]pyrimidin-1-ium-7-one Openeye Name: 5-(chloromethyl)-1-methyl-4H-pyrazolo[1,5-a]pyrimidin-1-ium-7-one CAS Name: 5-(chloromethyl)-1-methyl-4H-pyrazolo[1,5-a]pyrimidin-1-ium-7-one IUPAC Name: 5-(chloromethyl)-1-methyl-4H-pyrazolo[1,5-a]pyrimidin-1-ium-7-one Traditional Name: 5-(chloromethyl)-1-methyl-4H-pyrazolo[1,5-a]pyrimidin-1-ium-7-one Formula: C8H9ClN3O+ MolecularWeight: 198.62956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C2N1C(=O)C=C(N2)CCl

Isomeric SMILES

C[N+]1=CC=C2N1C(=O)C=C(N2)CCl

InChI

InChI=1S/C8H8ClN3O/c1-11-3-2-7-10-6(5-9)4-8(13)12(7)11/h2-4H,5H2,1H3/p+1