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

Systemtic Name: 3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-1-methyl-isochromenylium perchlorate Openeye Name: 3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-1-methyl-isochromenylium perchlorate CAS Name: 3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-1-methyl-2-benzopyrylium perchlorate IUPAC Name: 3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-1-methylisochromenylium perchlorate Traditional Name: 3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-1-methyl-2-benzopyrylium perchlorate Formula: C20H21ClO9 MolecularWeight: 440.82834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[O+]C(=CC2=CC(=C(C=C12)OC)OC)C3=CC(=C(C=C3)OC)OC.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=[O+]C(=CC2=CC(=C(C=C12)OC)OC)C3=CC(=C(C=C3)OC)OC.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C20H21O5.ClHO4/c1-12-15-11-20(24-5)19(23-4)10-14(15)9-17(25-12)13-6-7-16(21-2)18(8-13)22-3;2-1(3,4)5/h6-11H,1-5H3;(H,2,3,4,5)/q+1;/p-1