2-(4-bromophenyl)-5-(methoxymethyl)-1,4-dihydropyrazolo[1,5-a]pyrimidin-8-ium-7-one

Systemtic Name: 2-(4-bromophenyl)-5-(methoxymethyl)-1,4-dihydropyrazolo[1,5-a]pyrimidin-8-ium-7-one Openeye Name: 2-(4-bromophenyl)-5-(methoxymethyl)-1,4-dihydropyrazolo[1,5-a]pyrimidin-8-ium-7-one CAS Name: 2-(4-bromophenyl)-5-(methoxymethyl)-1,4-dihydropyrazolo[1,5-a]pyrimidin-8-ium-7-one IUPAC Name: 2-(4-bromophenyl)-5-(methoxymethyl)-1,4-dihydropyrazolo[1,5-a]pyrimidin-8-ium-7-one Traditional Name: 2-(4-bromophenyl)-5-(methoxymethyl)-1,4-dihydropyrazolo[1,5-a]pyrimidin-8-ium-7-one Formula: C14H13BrN3O2+ MolecularWeight: 335.17592

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC(=O)[N+]2=C(N1)C=C(N2)C3=CC=C(C=C3)Br

Isomeric SMILES

COCC1=CC(=O)[N+]2=C(N1)C=C(N2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C14H12BrN3O2/c1-20-8-11-6-14(19)18-13(16-11)7-12(17-18)9-2-4-10(15)5-3-9/h2-7H,8H2,1H3,(H,16,17,19)/p+1