6,7-dimethoxy-3,3-dimethyl-1-propan-2-yl-4H-isoquinolin-2-ium chloride

Systemtic Name: 6,7-dimethoxy-3,3-dimethyl-1-propan-2-yl-4H-isoquinolin-2-ium chloride Openeye Name: 1-isopropyl-6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-2-ium chloride CAS Name: 6,7-dimethoxy-3,3-dimethyl-1-propan-2-yl-4H-isoquinolin-2-ium chloride IUPAC Name: 6,7-dimethoxy-3,3-dimethyl-1-propan-2-yl-4H-isoquinolin-2-ium chloride Traditional Name: 1-isopropyl-6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-2-ium chloride Formula: C16H24ClNO2 MolecularWeight: 297.82026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=[NH+]C(CC2=CC(=C(C=C21)OC)OC)(C)C.[Cl-]

Isomeric SMILES

CC(C)C1=[NH+]C(CC2=CC(=C(C=C21)OC)OC)(C)C.[Cl-]

InChI

InChI=1S/C16H23NO2.ClH/c1-10(2)15-12-8-14(19-6)13(18-5)7-11(12)9-16(3,4)17-15;/h7-8,10H,9H2,1-6H3;1H