2-(7-methoxy-2-methyl-8-oxidanyl-4-phenyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)ethanenitrile

Systemtic Name: 2-(7-methoxy-2-methyl-8-oxidanyl-4-phenyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)ethanenitrile Openeye Name: 2-(8-hydroxy-7-methoxy-2-methyl-4-phenyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)acetonitrile CAS Name: 2-(8-hydroxy-7-methoxy-2-methyl-4-phenyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)acetonitrile IUPAC Name: 2-(8-hydroxy-7-methoxy-2-methyl-4-phenyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)acetonitrile Traditional Name: 2-(8-hydroxy-7-methoxy-2-methyl-4-phenyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)acetonitrile Formula: C19H21N2O2+ MolecularWeight: 309.38224

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CC(C2=C(C1)C(=C(C=C2)OC)O)C3=CC=CC=C3)CC#N

Isomeric SMILES

C[N+]1(CC(C2=C(C1)C(=C(C=C2)OC)O)C3=CC=CC=C3)CC#N

InChI

InChI=1S/C19H20N2O2/c1-21(11-10-20)12-16(14-6-4-3-5-7-14)15-8-9-18(23-2)19(22)17(15)13-21/h3-9,16H,11-13H2,1-2H3/p+1