2-(3,3-diphenylpropyl)-6,7-dimethoxy-3,3-dimethyl-2,4-dihydro-1H-isoquinolin-2-ium-4-ol chloride

Systemtic Name: 2-(3,3-diphenylpropyl)-6,7-dimethoxy-3,3-dimethyl-2,4-dihydro-1H-isoquinolin-2-ium-4-ol chloride Openeye Name: 2-(3,3-diphenylpropyl)-6,7-dimethoxy-3,3-dimethyl-2,4-dihydro-1H-isoquinolin-2-ium-4-ol chloride CAS Name: 2-(3,3-diphenylpropyl)-6,7-dimethoxy-3,3-dimethyl-2,4-dihydro-1H-isoquinolin-2-ium-4-ol chloride IUPAC Name: 2-(3,3-diphenylpropyl)-6,7-dimethoxy-3,3-dimethyl-2,4-dihydro-1H-isoquinolin-2-ium-4-ol chloride Traditional Name: 2-(3,3-diphenylpropyl)-6,7-dimethoxy-3,3-dimethyl-2,4-dihydro-1H-isoquinolin-2-ium-4-ol chloride Formula: C28H34ClNO3 MolecularWeight: 468.02746

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C2=CC(=C(C=C2C[NH+]1CCC(C3=CC=CC=C3)C4=CC=CC=C4)OC)OC)O)C.[Cl-]

Isomeric SMILES

CC1(C(C2=CC(=C(C=C2C[NH+]1CCC(C3=CC=CC=C3)C4=CC=CC=C4)OC)OC)O)C.[Cl-]

InChI

InChI=1S/C28H33NO3.ClH/c1-28(2)27(30)24-18-26(32-4)25(31-3)17-22(24)19-29(28)16-15-23(20-11-7-5-8-12-20)21-13-9-6-10-14-21;/h5-14,17-18,23,27,30H,15-16,19H2,1-4H3;1H