1-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]naphthalen-2-olate

Systemtic Name: 1-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]naphthalen-2-olate Openeye Name: 1-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]naphthalen-2-olate CAS Name: 1-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]-2-naphthalenolate IUPAC Name: 1-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]naphthalen-2-olate Traditional Name: 1-[[(3-amyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]naphthalen-2-olate Formula: C23H25N3O MolecularWeight: 359.4641

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+]1=C(NC2=CC=CC=C21)NCC3=C(C=CC4=CC=CC=C43)[O-]

Isomeric SMILES

CCCCC[N+]1=C(NC2=CC=CC=C21)NCC3=C(C=CC4=CC=CC=C43)[O-]

InChI

InChI=1S/C23H25N3O/c1-2-3-8-15-26-21-12-7-6-11-20(21)25-23(26)24-16-19-18-10-5-4-9-17(18)13-14-22(19)27/h4-7,9-14H,2-3,8,15-16H2,1H3,(H2,24,25,27)