1-[(1-oxidanidylpyridin-1-ium-4-yl)methyl]phthalazine

Systemtic Name: 1-[(1-oxidanidylpyridin-1-ium-4-yl)methyl]phthalazine Openeye Name: 1-[(1-oxidopyridin-1-ium-4-yl)methyl]phthalazine CAS Name: 1-[(1-oxido-4-pyridin-1-iumyl)methyl]phthalazine IUPAC Name: 1-[(1-oxidopyridin-1-ium-4-yl)methyl]phthalazine Traditional Name: 1-[(1-oxidopyridin-1-ium-4-yl)methyl]phthalazine Formula: C14H11N3O MolecularWeight: 237.25664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NN=C2CC3=CC=[N+](C=C3)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=NN=C2CC3=CC=[N+](C=C3)[O-]

InChI

InChI=1S/C14H11N3O/c18-17-7-5-11(6-8-17)9-14-13-4-2-1-3-12(13)10-15-16-14/h1-8,10H,9H2