1,2-dimethyl-3,4-dihydroisoquinolin-2-ium-6,7-diol bromide

Systemtic Name: 1,2-dimethyl-3,4-dihydroisoquinolin-2-ium-6,7-diol bromide Openeye Name: 1,2-dimethyl-3,4-dihydroisoquinolin-2-ium-6,7-diol bromide CAS Name: 1,2-dimethyl-3,4-dihydroisoquinolin-2-ium-6,7-diol bromide IUPAC Name: 1,2-dimethyl-3,4-dihydroisoquinolin-2-ium-6,7-diol bromide Traditional Name: 1,2-dimethyl-3,4-dihydroisoquinolin-2-ium-6,7-diol bromide Formula: C11H14BrNO2 MolecularWeight: 272.13836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](CCC2=CC(=C(C=C12)O)O)C.[Br-]

Isomeric SMILES

CC1=[N+](CCC2=CC(=C(C=C12)O)O)C.[Br-]

InChI

InChI=1S/C11H13NO2.BrH/c1-7-9-6-11(14)10(13)5-8(9)3-4-12(7)2;/h5-6,14H,3-4H2,1-2H3;1H