2-propan-2-yl-3,4-dihydroisoquinolin-2-ium-6,7-diol chloride

Systemtic Name: 2-propan-2-yl-3,4-dihydroisoquinolin-2-ium-6,7-diol chloride Openeye Name: 2-isopropyl-3,4-dihydroisoquinolin-2-ium-6,7-diol chloride CAS Name: 2-propan-2-yl-3,4-dihydroisoquinolin-2-ium-6,7-diol chloride IUPAC Name: 2-propan-2-yl-3,4-dihydroisoquinolin-2-ium-6,7-diol chloride Traditional Name: 2-isopropyl-3,4-dihydroisoquinolin-2-ium-6,7-diol chloride Formula: C12H16ClNO2 MolecularWeight: 241.71394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1=CC2=CC(=C(C=C2CC1)O)O.[Cl-]

Isomeric SMILES

CC(C)[N+]1=CC2=CC(=C(C=C2CC1)O)O.[Cl-]

InChI

InChI=1S/C12H15NO2.ClH/c1-8(2)13-4-3-9-5-11(14)12(15)6-10(9)7-13;/h5-8,15H,3-4H2,1-2H3;1H