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

Systemtic Name: 3-chloranyl-5-(chloromethyl)-1-ethyl-4H-pyrazolo[1,5-a]pyrimidin-1-ium-7-one Openeye Name: 3-chloro-5-(chloromethyl)-1-ethyl-4H-pyrazolo[1,5-a]pyrimidin-1-ium-7-one CAS Name: 3-chloro-5-(chloromethyl)-1-ethyl-4H-pyrazolo[1,5-a]pyrimidin-1-ium-7-one IUPAC Name: 3-chloro-5-(chloromethyl)-1-ethyl-4H-pyrazolo[1,5-a]pyrimidin-1-ium-7-one Traditional Name: 3-chloro-5-(chloromethyl)-1-ethyl-4H-pyrazolo[1,5-a]pyrimidin-1-ium-7-one Formula: C9H10Cl2N3O+ MolecularWeight: 247.1012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9Cl2N3O/c1-2-13-5-7(11)9-12-6(4-10)3-8(15)14(9)13/h3,5H,2,4H2,1H3/p+1