5,6-dimethoxy-2-methyl-2-(phenylmethyl)-1,3-dihydroisoindol-2-ium chloride

Systemtic Name: 5,6-dimethoxy-2-methyl-2-(phenylmethyl)-1,3-dihydroisoindol-2-ium chloride Openeye Name: 2-benzyl-5,6-dimethoxy-2-methyl-isoindolin-2-ium chloride CAS Name: 5,6-dimethoxy-2-methyl-2-(phenylmethyl)-1,3-dihydroisoindol-2-ium chloride IUPAC Name: 2-benzyl-5,6-dimethoxy-2-methyl-1,3-dihydroisoindol-2-ium chloride Traditional Name: 2-benzyl-5,6-dimethoxy-2-methyl-isoindolin-2-ium chloride Formula: C18H22ClNO2 MolecularWeight: 319.82578

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CC2=CC(=C(C=C2C1)OC)OC)CC3=CC=CC=C3.[Cl-]

Isomeric SMILES

C[N+]1(CC2=CC(=C(C=C2C1)OC)OC)CC3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C18H22NO2.ClH/c1-19(11-14-7-5-4-6-8-14)12-15-9-17(20-2)18(21-3)10-16(15)13-19;/h4-10H,11-13H2,1-3H3;1H/q+1;/p-1