2-[2-azanyl-3-(2-naphthalen-1-yloxyethyl)benzimidazol-1-ium-1-yl]ethanamide chloride

Systemtic Name: 2-[2-azanyl-3-(2-naphthalen-1-yloxyethyl)benzimidazol-1-ium-1-yl]ethanamide chloride Openeye Name: 2-[2-amino-3-[2-(1-naphthyloxy)ethyl]benzimidazol-1-ium-1-yl]acetamide chloride CAS Name: 2-[2-amino-3-[2-(1-naphthalenyloxy)ethyl]-1-benzimidazol-1-iumyl]acetamide chloride IUPAC Name: 2-[2-amino-3-(2-naphthalen-1-yloxyethyl)benzimidazol-1-ium-1-yl]acetamide chloride Traditional Name: 2-[2-amino-3-[2-(1-naphthoxy)ethyl]benzimidazol-1-ium-1-yl]acetamide chloride Formula: C21H21ClN4O2 MolecularWeight: 396.87004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2OCCN3C4=CC=CC=C4[N+](=C3N)CC(=O)N.[Cl-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2OCCN3C4=CC=CC=C4[N+](=C3N)CC(=O)N.[Cl-]

InChI

InChI=1S/C21H20N4O2.ClH/c22-20(26)14-25-18-10-4-3-9-17(18)24(21(25)23)12-13-27-19-11-5-7-15-6-1-2-8-16(15)19;/h1-11,23H,12-14H2,(H2,22,26);1H