2-[(E)-2-(3,3-dimethyl-2-benzofuran-2-ium-1-yl)ethenyl]phenol perchlorate

Systemtic Name: 2-[(E)-2-(3,3-dimethyl-2-benzofuran-2-ium-1-yl)ethenyl]phenol perchlorate Openeye Name: 2-[(E)-2-(3,3-dimethylisobenzofuran-2-ium-1-yl)vinyl]phenol perchlorate CAS Name: 2-[(E)-2-(3,3-dimethyl-1-isobenzofuran-2-iumyl)ethenyl]phenol perchlorate IUPAC Name: 2-[(E)-2-(3,3-dimethyl-2-benzofuran-2-ium-1-yl)ethenyl]phenol perchlorate Traditional Name: 2-[(E)-2-(3,3-dimethylisobenzofuran-2-ium-1-yl)vinyl]phenol perchlorate Formula: C18H17ClO6 MolecularWeight: 364.77698

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2C(=[O+]1)C=CC3=CC=CC=C3O)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1(C2=CC=CC=C2C(=[O+]1)/C=C/C3=CC=CC=C3O)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C18H16O2.ClHO4/c1-18(2)15-9-5-4-8-14(15)17(20-18)12-11-13-7-3-6-10-16(13)19;2-1(3,4)5/h3-12H,1-2H3;(H,2,3,4,5)/b12-11+;