N-(3-ethanoylphenyl)-2-isoquinolin-2-ium-2-yl-ethanamide

Systemtic Name: N-(3-ethanoylphenyl)-2-isoquinolin-2-ium-2-yl-ethanamide Openeye Name: N-(3-acetylphenyl)-2-isoquinolin-2-ium-2-yl-acetamide CAS Name: N-(3-acetylphenyl)-2-(2-isoquinolin-2-iumyl)acetamide IUPAC Name: N-(3-acetylphenyl)-2-isoquinolin-2-ium-2-ylacetamide Traditional Name: N-(3-acetylphenyl)-2-isoquinolin-2-ium-2-yl-acetamide Formula: C19H17N2O2+ MolecularWeight: 305.35048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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