4-[(E)-2-(4-methoxyphenyl)ethenyl]-2,2-dimethyl-6-phenyl-1,3-dioxin-1-ium perchlorate

Systemtic Name: 4-[(E)-2-(4-methoxyphenyl)ethenyl]-2,2-dimethyl-6-phenyl-1,3-dioxin-1-ium perchlorate Openeye Name: 4-[(E)-2-(4-methoxyphenyl)vinyl]-2,2-dimethyl-6-phenyl-1,3-dioxin-1-ium perchlorate CAS Name: 4-[(E)-2-(4-methoxyphenyl)ethenyl]-2,2-dimethyl-6-phenyl-1,3-dioxin-1-ium perchlorate IUPAC Name: 4-[(E)-2-(4-methoxyphenyl)ethenyl]-2,2-dimethyl-6-phenyl-1,3-dioxin-1-ium perchlorate Traditional Name: 4-[(E)-2-(4-methoxyphenyl)vinyl]-2,2-dimethyl-6-phenyl-1,3-dioxin-1-ium perchlorate Formula: C21H21ClO7 MolecularWeight: 420.84024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=CC(=[O+]1)C2=CC=CC=C2)C=CC3=CC=C(C=C3)OC)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1(OC(=CC(=[O+]1)C2=CC=CC=C2)/C=C/C3=CC=C(C=C3)OC)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C21H21O3.ClHO4/c1-21(2)23-19(14-11-16-9-12-18(22-3)13-10-16)15-20(24-21)17-7-5-4-6-8-17;2-1(3,4)5/h4-15H,1-3H3;(H,2,3,4,5)/q+1;/p-1/b14-11+;