6,7-dimethoxy-1-(4-methoxyphenyl)-3-methyl-isochromenylium perchlorate

Systemtic Name: 6,7-dimethoxy-1-(4-methoxyphenyl)-3-methyl-isochromenylium perchlorate Openeye Name: 6,7-dimethoxy-1-(4-methoxyphenyl)-3-methyl-isochromenylium perchlorate CAS Name: 6,7-dimethoxy-1-(4-methoxyphenyl)-3-methyl-2-benzopyrylium perchlorate IUPAC Name: 6,7-dimethoxy-1-(4-methoxyphenyl)-3-methylisochromenylium perchlorate Traditional Name: 6,7-dimethoxy-1-(4-methoxyphenyl)-3-methyl-2-benzopyrylium perchlorate Formula: C19H19ClO8 MolecularWeight: 410.80236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(C=C2C(=[O+]1)C3=CC=C(C=C3)OC)OC)OC.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC2=CC(=C(C=C2C(=[O+]1)C3=CC=C(C=C3)OC)OC)OC.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C19H19O4.ClHO4/c1-12-9-14-10-17(21-3)18(22-4)11-16(14)19(23-12)13-5-7-15(20-2)8-6-13;2-1(3,4)5/h5-11H,1-4H3;(H,2,3,4,5)/q+1;/p-1