4-(5-nitrothiophen-2-yl)-2,6-diphenyl-pyrylium perchlorate

Systemtic Name: 4-(5-nitrothiophen-2-yl)-2,6-diphenyl-pyrylium perchlorate Openeye Name: 4-(5-nitro-2-thienyl)-2,6-diphenyl-pyrylium perchlorate CAS Name: 4-(5-nitro-2-thiophenyl)-2,6-diphenylpyrylium perchlorate IUPAC Name: 4-(5-nitrothiophen-2-yl)-2,6-diphenylpyrylium perchlorate Traditional Name: 4-(5-nitro-2-thienyl)-2,6-diphenyl-pyrylium perchlorate Formula: C21H14ClNO7S MolecularWeight: 459.85636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=CC(=[O+]2)C3=CC=CC=C3)C4=CC=C(S4)[N+](=O)[O-].[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=CC(=[O+]2)C3=CC=CC=C3)C4=CC=C(S4)[N+](=O)[O-].[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C21H14NO3S.ClHO4/c23-22(24)21-12-11-20(26-21)17-13-18(15-7-3-1-4-8-15)25-19(14-17)16-9-5-2-6-10-16;2-1(3,4)5/h1-14H;(H,2,3,4,5)/q+1;/p-1