5-(furan-3-yl)-7-[(1-oxidanidylpyridin-1-ium-4-yl)methoxy]pyrazolo[1,5-a]pyrimidine

Systemtic Name: 5-(furan-3-yl)-7-[(1-oxidanidylpyridin-1-ium-4-yl)methoxy]pyrazolo[1,5-a]pyrimidine Openeye Name: 5-(3-furyl)-7-[(1-oxidopyridin-1-ium-4-yl)methoxy]pyrazolo[1,5-a]pyrimidine CAS Name: 5-(3-furanyl)-7-[(1-oxido-4-pyridin-1-iumyl)methoxy]pyrazolo[1,5-a]pyrimidine IUPAC Name: 5-(furan-3-yl)-7-[(1-oxidopyridin-1-ium-4-yl)methoxy]pyrazolo[1,5-a]pyrimidine Traditional Name: 5-(3-furyl)-7-[(1-oxidopyridin-1-ium-4-yl)methoxy]pyrazolo[1,5-a]pyrimidine Formula: C16H12N4O3 MolecularWeight: 308.29148

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Descriptors Computed from Structure

Canonical SMILES:

C1=C[N+](=CC=C1COC2=CC(=NC3=CC=NN32)C4=COC=C4)[O-]

Isomeric SMILES

C1=C[N+](=CC=C1COC2=CC(=NC3=CC=NN32)C4=COC=C4)[O-]

InChI

InChI=1S/C16H12N4O3/c21-19-6-2-12(3-7-19)10-23-16-9-14(13-4-8-22-11-13)18-15-1-5-17-20(15)16/h1-9,11H,10H2