5-(furan-2-yl)-7-[(1-oxidanidylpyridin-1-ium-3-yl)methoxy]pyrazolo[1,5-a]pyrimidine

Systemtic Name: 5-(furan-2-yl)-7-[(1-oxidanidylpyridin-1-ium-3-yl)methoxy]pyrazolo[1,5-a]pyrimidine Openeye Name: 5-(2-furyl)-7-[(1-oxidopyridin-1-ium-3-yl)methoxy]pyrazolo[1,5-a]pyrimidine CAS Name: 5-(2-furanyl)-7-[(1-oxido-3-pyridin-1-iumyl)methoxy]pyrazolo[1,5-a]pyrimidine IUPAC Name: 5-(furan-2-yl)-7-[(1-oxidopyridin-1-ium-3-yl)methoxy]pyrazolo[1,5-a]pyrimidine Traditional Name: 5-(2-furyl)-7-[(1-oxidopyridin-1-ium-3-yl)methoxy]pyrazolo[1,5-a]pyrimidine Formula: C16H12N4O3 MolecularWeight: 308.29148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)[O-])COC2=CC(=NC3=CC=NN32)C4=CC=CO4

Isomeric SMILES

C1=CC(=C[N+](=C1)[O-])COC2=CC(=NC3=CC=NN32)C4=CC=CO4

InChI

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