(1R)-2-(6,7-dimethoxy-2-oxidanidyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)-1-phenyl-ethanol

Systemtic Name: (1R)-2-(6,7-dimethoxy-2-oxidanidyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)-1-phenyl-ethanol Openeye Name: (1R)-2-(6,7-dimethoxy-2-oxido-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)-1-phenyl-ethanol CAS Name: (1R)-2-(6,7-dimethoxy-2-oxido-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)-1-phenylethanol IUPAC Name: (1R)-2-(6,7-dimethoxy-2-oxido-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)-1-phenylethanol Traditional Name: (1R)-2-(6,7-dimethoxy-2-oxido-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)-1-phenyl-ethanol Formula: C19H23NO4 MolecularWeight: 329.39022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C[N+](CCC2=C1)(CC(C3=CC=CC=C3)O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C[N+](CCC2=C1)(C[C@@H](C3=CC=CC=C3)O)[O-])OC

InChI

InChI=1S/C19H23NO4/c1-23-18-10-15-8-9-20(22,12-16(15)11-19(18)24-2)13-17(21)14-6-4-3-5-7-14/h3-7,10-11,17,21H,8-9,12-13H2,1-2H3/t17-,20?/m0/s1