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

Systemtic Name: 5-(4-chlorophenyl)-1-methyl-4H-pyrazolo[1,5-a]pyrimidin-1-ium-7-one Openeye Name: 5-(4-chlorophenyl)-1-methyl-4H-pyrazolo[1,5-a]pyrimidin-1-ium-7-one CAS Name: 5-(4-chlorophenyl)-1-methyl-4H-pyrazolo[1,5-a]pyrimidin-1-ium-7-one IUPAC Name: 5-(4-chlorophenyl)-1-methyl-4H-pyrazolo[1,5-a]pyrimidin-1-ium-7-one Traditional Name: 5-(4-chlorophenyl)-1-methyl-4H-pyrazolo[1,5-a]pyrimidin-1-ium-7-one Formula: C13H11ClN3O+ MolecularWeight: 260.69894

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C2N1C(=O)C=C(N2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C[N+]1=CC=C2N1C(=O)C=C(N2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C13H10ClN3O/c1-16-7-6-12-15-11(8-13(18)17(12)16)9-2-4-10(14)5-3-9/h2-8H,1H3/p+1