2-[2-(2-naphthalen-1-yloxyethoxymethylamino)ethyl]-N-phenyl-quinolin-1-ium-1-carboxamide

Systemtic Name: 2-[2-(2-naphthalen-1-yloxyethoxymethylamino)ethyl]-N-phenyl-quinolin-1-ium-1-carboxamide Openeye Name: 2-[2-[2-(1-naphthyloxy)ethoxymethylamino]ethyl]-N-phenyl-quinolin-1-ium-1-carboxamide CAS Name: 2-[2-[2-(1-naphthalenyloxy)ethoxymethylamino]ethyl]-N-phenyl-1-quinolin-1-iumcarboxamide IUPAC Name: 2-[2-(2-naphthalen-1-yloxyethoxymethylamino)ethyl]-N-phenylquinolin-1-ium-1-carboxamide Traditional Name: 2-[2-[2-(1-naphthoxy)ethoxymethylamino]ethyl]-N-phenyl-quinolin-1-ium-1-carboxamide Formula: C31H30N3O3+ MolecularWeight: 492.5882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)[N+]2=C(C=CC3=CC=CC=C32)CCNCOCCOC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)[N+]2=C(C=CC3=CC=CC=C32)CCNCOCCOC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C31H29N3O3/c35-31(33-26-12-2-1-3-13-26)34-27(18-17-25-10-5-7-15-29(25)34)19-20-32-23-36-21-22-37-30-16-8-11-24-9-4-6-14-28(24)30/h1-18,32H,19-23H2/p+1