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

Systemtic Name: 3-(4-ethoxyphenyl)-6,7-dimethoxy-1-methyl-4-phenyl-isochromenylium perchlorate Openeye Name: 3-(4-ethoxyphenyl)-6,7-dimethoxy-1-methyl-4-phenyl-isochromenylium perchlorate CAS Name: 3-(4-ethoxyphenyl)-6,7-dimethoxy-1-methyl-4-phenyl-2-benzopyrylium perchlorate IUPAC Name: 3-(4-ethoxyphenyl)-6,7-dimethoxy-1-methyl-4-phenylisochromenylium perchlorate Traditional Name: 6,7-dimethoxy-1-methyl-4-phenyl-3-p-phenetyl-2-benzopyrylium perchlorate Formula: C26H25ClO8 MolecularWeight: 500.9249

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(C3=CC(=C(C=C3C(=[O+]2)C)OC)OC)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(C3=CC(=C(C=C3C(=[O+]2)C)OC)OC)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C26H25O4.ClHO4/c1-5-29-20-13-11-19(12-14-20)26-25(18-9-7-6-8-10-18)22-16-24(28-4)23(27-3)15-21(22)17(2)30-26;2-1(3,4)5/h6-16H,5H2,1-4H3;(H,2,3,4,5)/q+1;/p-1