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

Systemtic Name: 3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-1-(4-methoxyphenyl)isochromenylium perchlorate Openeye Name: 3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-1-(4-methoxyphenyl)isochromenylium perchlorate CAS Name: 3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-1-(4-methoxyphenyl)-2-benzopyrylium perchlorate IUPAC Name: 3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-1-(4-methoxyphenyl)isochromenylium perchlorate Traditional Name: 3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-1-(4-methoxyphenyl)-2-benzopyrylium perchlorate Formula: C26H25ClO10 MolecularWeight: 532.9237

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=[O+]C(=CC3=CC(=C(C=C32)OC)OC)C4=CC(=C(C=C4)OC)OC.[O-]Cl(=O)(=O)=O

Isomeric SMILES

COC1=CC=C(C=C1)C2=[O+]C(=CC3=CC(=C(C=C32)OC)OC)C4=CC(=C(C=C4)OC)OC.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C26H25O6.ClHO4/c1-27-19-9-6-16(7-10-19)26-20-15-25(31-5)24(30-4)14-18(20)13-22(32-26)17-8-11-21(28-2)23(12-17)29-3;2-1(3,4)5/h6-15H,1-5H3;(H,2,3,4,5)/q+1;/p-1