2-isoquinolin-2-ium-2-yl-1-phenyl-ethanol

Systemtic Name: 2-isoquinolin-2-ium-2-yl-1-phenyl-ethanol Openeye Name: 2-isoquinolin-2-ium-2-yl-1-phenyl-ethanol CAS Name: 2-(2-isoquinolin-2-iumyl)-1-phenylethanol IUPAC Name: 2-isoquinolin-2-ium-2-yl-1-phenylethanol Traditional Name: 2-isoquinolin-2-ium-2-yl-1-phenyl-ethanol Formula: C17H16NO+ MolecularWeight: 250.31504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C[N+]2=CC3=CC=CC=C3C=C2)O

Isomeric SMILES

C1=CC=C(C=C1)C(C[N+]2=CC3=CC=CC=C3C=C2)O

InChI

InChI=1S/C17H16NO/c19-17(15-7-2-1-3-8-15)13-18-11-10-14-6-4-5-9-16(14)12-18/h1-12,17,19H,13H2/q+1