5-naphthalen-1-yl-2-phenyl-3-(4-phenylphenyl)-1,2,3,4-tetrazol-3-ium chloride

Systemtic Name: 5-naphthalen-1-yl-2-phenyl-3-(4-phenylphenyl)-1,2,3,4-tetrazol-3-ium chloride Openeye Name: 5-(1-naphthyl)-2-phenyl-3-(4-phenylphenyl)tetrazol-3-ium chloride CAS Name: 5-(1-naphthalenyl)-2-phenyl-3-(4-phenylphenyl)tetrazol-3-ium chloride IUPAC Name: 5-naphthalen-1-yl-2-phenyl-3-(4-phenylphenyl)tetrazol-3-ium chloride Traditional Name: 5-(1-naphthyl)-2-phenyl-3-(4-phenylphenyl)tetrazol-3-ium chloride Formula: C29H21ClN4 MolecularWeight: 460.95684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)[N+]3=NC(=NN3C4=CC=CC=C4)C5=CC=CC6=CC=CC=C65.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)[N+]3=NC(=NN3C4=CC=CC=C4)C5=CC=CC6=CC=CC=C65.[Cl-]

InChI

InChI=1S/C29H21N4.ClH/c1-3-10-22(11-4-1)23-18-20-26(21-19-23)33-31-29(30-32(33)25-14-5-2-6-15-25)28-17-9-13-24-12-7-8-16-27(24)28;/h1-21H;1H/q+1;/p-1