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

Systemtic Name: 3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-isochromenylium perchlorate Openeye Name: 3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-isochromenylium perchlorate CAS Name: 3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-benzopyrylium perchlorate IUPAC Name: 3-(3,4-dimethoxyphenyl)-6,7-dimethoxyisochromenylium perchlorate Traditional Name: 3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-benzopyrylium perchlorate Formula: C19H19ClO9 MolecularWeight: 426.80176

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC3=CC(=C(C=C3C=[O+]2)OC)OC)OC.[O-]Cl(=O)(=O)=O

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC3=CC(=C(C=C3C=[O+]2)OC)OC)OC.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C19H19O5.ClHO4/c1-20-15-6-5-12(7-17(15)21-2)16-8-13-9-18(22-3)19(23-4)10-14(13)11-24-16;2-1(3,4)5/h5-11H,1-4H3;(H,2,3,4,5)/q+1;/p-1