2-[2-(5,6,7,8-tetrahydroisochromen-2-ium-1-yl)ethenyl]phenol perchlorate

Systemtic Name: 2-[2-(5,6,7,8-tetrahydroisochromen-2-ium-1-yl)ethenyl]phenol perchlorate Openeye Name: 2-[2-(5,6,7,8-tetrahydroisochromen-2-ium-1-yl)vinyl]phenol perchlorate CAS Name: 2-[2-(5,6,7,8-tetrahydro-2-benzopyran-2-ium-1-yl)ethenyl]phenol perchlorate IUPAC Name: 2-[2-(5,6,7,8-tetrahydroisochromen-2-ium-1-yl)ethenyl]phenol perchlorate Traditional Name: 2-[2-(5,6,7,8-tetrahydroisochromen-2-ium-1-yl)vinyl]phenol perchlorate Formula: C17H17ClO6 MolecularWeight: 352.76628

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C[O+]=C2C=CC3=CC=CC=C3O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1CCC2=C(C1)C=C[O+]=C2C=CC3=CC=CC=C3O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C17H16O2.ClHO4/c18-16-8-4-2-6-14(16)9-10-17-15-7-3-1-5-13(15)11-12-19-17;2-1(3,4)5/h2,4,6,8-12H,1,3,5,7H2;(H,2,3,4,5)