1,3-dibutyl-2-methyl-2H-imidazo[4,5-b]quinoxalin-9-ium chloride

Systemtic Name: 1,3-dibutyl-2-methyl-2H-imidazo[4,5-b]quinoxalin-9-ium chloride Openeye Name: 1,3-dibutyl-2-methyl-2H-imidazo[4,5-b]quinoxalin-9-ium chloride CAS Name: 1,3-dibutyl-2-methyl-2H-imidazo[4,5-b]quinoxalin-9-ium chloride IUPAC Name: 1,3-dibutyl-2-methyl-2H-imidazo[4,5-b]quinoxalin-9-ium chloride Traditional Name: 1,3-dibutyl-2-methyl-2H-imidazo[4,5-b]quinoxalin-9-ium chloride Formula: C18H27ClN4 MolecularWeight: 334.88678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(N(C2=NC3=CC=CC=C3[NH+]=C21)CCCC)C.[Cl-]

Isomeric SMILES

CCCCN1C(N(C2=NC3=CC=CC=C3[NH+]=C21)CCCC)C.[Cl-]

InChI

InChI=1S/C18H26N4.ClH/c1-4-6-12-21-14(3)22(13-7-5-2)18-17(21)19-15-10-8-9-11-16(15)20-18;/h8-11,14H,4-7,12-13H2,1-3H3;1H