2-phenyl-3-pyridin-4-yl-1,5,6,7-tetrahydroindazol-2-ium-4-one

Systemtic Name: 2-phenyl-3-pyridin-4-yl-1,5,6,7-tetrahydroindazol-2-ium-4-one Openeye Name: 2-phenyl-3-(4-pyridyl)-1,5,6,7-tetrahydroindazol-2-ium-4-one CAS Name: 2-phenyl-3-pyridin-4-yl-1,5,6,7-tetrahydroindazol-2-ium-4-one IUPAC Name: 2-phenyl-3-pyridin-4-yl-1,5,6,7-tetrahydroindazol-2-ium-4-one Traditional Name: 2-phenyl-3-(4-pyridyl)-1,5,6,7-tetrahydroindazol-2-ium-4-one Formula: C18H16N3O+ MolecularWeight: 290.33914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=O)C1)C(=[N+](N2)C3=CC=CC=C3)C4=CC=NC=C4

Isomeric SMILES

C1CC2=C(C(=O)C1)C(=[N+](N2)C3=CC=CC=C3)C4=CC=NC=C4

InChI

InChI=1S/C18H15N3O/c22-16-8-4-7-15-17(16)18(13-9-11-19-12-10-13)21(20-15)14-5-2-1-3-6-14/h1-3,5-6,9-12H,4,7-8H2/p+1