N-(4-ethanoylphenyl)-2-isoquinolin-2-ium-2-yl-ethanamide

Systemtic Name: N-(4-ethanoylphenyl)-2-isoquinolin-2-ium-2-yl-ethanamide Openeye Name: N-(4-acetylphenyl)-2-isoquinolin-2-ium-2-yl-acetamide CAS Name: N-(4-acetylphenyl)-2-(2-isoquinolin-2-iumyl)acetamide IUPAC Name: N-(4-acetylphenyl)-2-isoquinolin-2-ium-2-ylacetamide Traditional Name: N-(4-acetylphenyl)-2-isoquinolin-2-ium-2-yl-acetamide Formula: C19H17N2O2+ MolecularWeight: 305.35048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16N2O2/c1-14(22)15-6-8-18(9-7-15)20-19(23)13-21-11-10-16-4-2-3-5-17(16)12-21/h2-12H,13H2,1H3/p+1