2,4-bis(4-decoxyphenyl)-6-methyl-pyrylium perchlorate

Systemtic Name: 2,4-bis(4-decoxyphenyl)-6-methyl-pyrylium perchlorate Openeye Name: 2,4-bis(4-decoxyphenyl)-6-methyl-pyrylium perchlorate CAS Name: 2,4-bis(4-decoxyphenyl)-6-methylpyrylium perchlorate IUPAC Name: 2,4-bis(4-decoxyphenyl)-6-methylpyrylium perchlorate Traditional Name: 2,4-bis(4-decoxyphenyl)-6-methyl-pyrylium perchlorate Formula: C38H55ClO7 MolecularWeight: 659.2921

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC(=[O+]C(=C2)C)C3=CC=C(C=C3)OCCCCCCCCCC.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC(=[O+]C(=C2)C)C3=CC=C(C=C3)OCCCCCCCCCC.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C38H55O3.ClHO4/c1-4-6-8-10-12-14-16-18-28-39-36-24-20-33(21-25-36)35-30-32(3)41-38(31-35)34-22-26-37(27-23-34)40-29-19-17-15-13-11-9-7-5-2;2-1(3,4)5/h20-27,30-31H,4-19,28-29H2,1-3H3;(H,2,3,4,5)/q+1;/p-1