5-phenyl-2,3-dihydro-1H-pyrazolo[1,2-a]indazol-4-ium-7-carbonitrile bromide

Systemtic Name: 5-phenyl-2,3-dihydro-1H-pyrazolo[1,2-a]indazol-4-ium-7-carbonitrile bromide Openeye Name: 5-phenyl-2,3-dihydro-1H-pyrazolo[1,2-a]indazol-4-ium-7-carbonitrile bromide CAS Name: 5-phenyl-2,3-dihydro-1H-pyrazolo[1,2-a]indazol-4-ium-7-carbonitrile bromide IUPAC Name: 5-phenyl-2,3-dihydro-1H-pyrazolo[1,2-a]indazol-4-ium-7-carbonitrile bromide Traditional Name: 5-phenyl-2,3-dihydro-1H-pyrazol[1,2-a]indazol-4-ium-7-carbonitrile bromide Formula: C17H14BrN3 MolecularWeight: 340.21716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN2C3=C(C=C(C=C3)C#N)C(=[N+]2C1)C4=CC=CC=C4.[Br-]

Isomeric SMILES

C1CN2C3=C(C=C(C=C3)C#N)C(=[N+]2C1)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C17H14N3.BrH/c18-12-13-7-8-16-15(11-13)17(14-5-2-1-3-6-14)20-10-4-9-19(16)20;/h1-3,5-8,11H,4,9-10H2;1H/q+1;/p-1