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

Systemtic Name: 6,7-dimethoxy-3,3-dimethyl-2-(phenylmethyl)-2,4-dihydro-1H-isoquinolin-2-ium Openeye Name: 2-benzyl-6,7-dimethoxy-3,3-dimethyl-2,4-dihydro-1H-isoquinolin-2-ium CAS Name: 6,7-dimethoxy-3,3-dimethyl-2-(phenylmethyl)-2,4-dihydro-1H-isoquinolin-2-ium IUPAC Name: 2-benzyl-6,7-dimethoxy-3,3-dimethyl-2,4-dihydro-1H-isoquinolin-2-ium Traditional Name: 2-benzyl-6,7-dimethoxy-3,3-dimethyl-2,4-dihydro-1H-isoquinolin-2-ium Formula: C20H26NO2+ MolecularWeight: 312.42594

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC(=C(C=C2C[NH+]1CC3=CC=CC=C3)OC)OC)C

Isomeric SMILES

CC1(CC2=CC(=C(C=C2C[NH+]1CC3=CC=CC=C3)OC)OC)C

InChI

InChI=1S/C20H25NO2/c1-20(2)12-16-10-18(22-3)19(23-4)11-17(16)14-21(20)13-15-8-6-5-7-9-15/h5-11H,12-14H2,1-4H3/p+1