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

Systemtic Name: 1-ethyl-6,7-dimethoxy-3-(4-methoxyphenyl)isochromenylium perchlorate Openeye Name: 1-ethyl-6,7-dimethoxy-3-(4-methoxyphenyl)isochromenylium perchlorate CAS Name: 1-ethyl-6,7-dimethoxy-3-(4-methoxyphenyl)-2-benzopyrylium perchlorate IUPAC Name: 1-ethyl-6,7-dimethoxy-3-(4-methoxyphenyl)isochromenylium perchlorate Traditional Name: 1-ethyl-6,7-dimethoxy-3-(4-methoxyphenyl)-2-benzopyrylium perchlorate Formula: C20H21ClO8 MolecularWeight: 424.82894

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=[O+]C(=CC2=CC(=C(C=C21)OC)OC)C3=CC=C(C=C3)OC.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCC1=[O+]C(=CC2=CC(=C(C=C21)OC)OC)C3=CC=C(C=C3)OC.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C20H21O4.ClHO4/c1-5-17-16-12-20(23-4)19(22-3)11-14(16)10-18(24-17)13-6-8-15(21-2)9-7-13;2-1(3,4)5/h6-12H,5H2,1-4H3;(H,2,3,4,5)/q+1;/p-1