N-[2-(4-chlorophenyl)ethyl]-2-isoquinolin-2-ium-2-yl-ethanamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-2-isoquinolin-2-ium-2-yl-ethanamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-2-isoquinolin-2-ium-2-yl-acetamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-2-(2-isoquinolin-2-iumyl)acetamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-2-isoquinolin-2-ium-2-ylacetamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-2-isoquinolin-2-ium-2-yl-acetamide Formula: C19H18ClN2O+ MolecularWeight: 325.81202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=[N+](C=CC2=C1)CC(=O)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C=[N+](C=CC2=C1)CC(=O)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H17ClN2O/c20-18-7-5-15(6-8-18)9-11-21-19(23)14-22-12-10-16-3-1-2-4-17(16)13-22/h1-8,10,12-13H,9,11,14H2/p+1