N-(2-isoquinolin-2-ium-2-ylethyl)benzamide

Systemtic Name: N-(2-isoquinolin-2-ium-2-ylethyl)benzamide Openeye Name: N-(2-isoquinolin-2-ium-2-ylethyl)benzamide CAS Name: N-[2-(2-isoquinolin-2-iumyl)ethyl]benzamide IUPAC Name: N-(2-isoquinolin-2-ium-2-ylethyl)benzamide Traditional Name: N-(2-isoquinolin-2-ium-2-ylethyl)benzamide Formula: C18H17N2O+ MolecularWeight: 277.34038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N2O/c21-18(16-7-2-1-3-8-16)19-11-13-20-12-10-15-6-4-5-9-17(15)14-20/h1-10,12,14H,11,13H2/p+1