3-methyl-2-phenyl-phenanthro[9,10-d][1,2,3]triazol-3-ium perchlorate

Systemtic Name: 3-methyl-2-phenyl-phenanthro[9,10-d][1,2,3]triazol-3-ium perchlorate Openeye Name: 3-methyl-2-phenyl-phenanthro[9,10-d]triazol-3-ium perchlorate CAS Name: 3-methyl-2-phenylphenanthro[9,10-d]triazol-3-ium perchlorate IUPAC Name: 3-methyl-2-phenylphenanthro[9,10-d]triazol-3-ium perchlorate Traditional Name: 3-methyl-2-phenyl-phenanthro[9,10-d]triazol-3-ium perchlorate Formula: C21H16ClN3O4 MolecularWeight: 409.82244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C3=CC=CC=C3C4=CC=CC=C4C2=NN1C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C[N+]1=C2C3=CC=CC=C3C4=CC=CC=C4C2=NN1C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C21H16N3.ClHO4/c1-23-21-19-14-8-6-12-17(19)16-11-5-7-13-18(16)20(21)22-24(23)15-9-3-2-4-10-15;2-1(3,4)5/h2-14H,1H3;(H,2,3,4,5)/q+1;/p-1