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

Systemtic Name: 1,3-dibutyl-2-methyl-imidazo[4,5-b]quinoxalin-3-ium chloride Openeye Name: 1,3-dibutyl-2-methyl-imidazo[4,5-b]quinoxalin-3-ium chloride CAS Name: 1,3-dibutyl-2-methylimidazo[4,5-b]quinoxalin-3-ium chloride IUPAC Name: 1,3-dibutyl-2-methylimidazo[4,5-b]quinoxalin-3-ium chloride Traditional Name: 1,3-dibutyl-2-methyl-imidazo[4,5-b]quinoxalin-3-ium chloride Formula: C18H25ClN4 MolecularWeight: 332.8709

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=[N+](C2=NC3=CC=CC=C3N=C21)CCCC)C.[Cl-]

Isomeric SMILES

CCCCN1C(=[N+](C2=NC3=CC=CC=C3N=C21)CCCC)C.[Cl-]

InChI

InChI=1S/C18H25N4.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;/h8-11H,4-7,12-13H2,1-3H3;1H/q+1;/p-1