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

Systemtic Name: 1-[[(3-heptyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]naphthalen-2-olate Openeye Name: 1-[[(3-heptyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]naphthalen-2-olate CAS Name: 1-[[(3-heptyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]-2-naphthalenolate IUPAC Name: 1-[[(3-heptyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]naphthalen-2-olate Traditional Name: 1-[[(3-heptyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]naphthalen-2-olate Formula: C25H29N3O MolecularWeight: 387.51726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29N3O/c1-2-3-4-5-10-17-28-23-14-9-8-13-22(23)27-25(28)26-18-21-20-12-7-6-11-19(20)15-16-24(21)29/h6-9,11-16H,2-5,10,17-18H2,1H3,(H2,26,27,29)