N2-butyl-N4-ethyl-1,6-dimethyl-N4-phenyl-1,3,5-triazin-1-ium-2,4-diamine chloride

Systemtic Name: N2-butyl-N4-ethyl-1,6-dimethyl-N4-phenyl-1,3,5-triazin-1-ium-2,4-diamine chloride Openeye Name: N2-butyl-N4-ethyl-1,6-dimethyl-N4-phenyl-1,3,5-triazin-1-ium-2,4-diamine chloride CAS Name: N2-butyl-N4-ethyl-1,6-dimethyl-N4-phenyl-1,3,5-triazin-1-ium-2,4-diamine chloride IUPAC Name: 2-N-butyl-4-N-ethyl-1,6-dimethyl-4-N-phenyl-1,3,5-triazin-1-ium-2,4-diamine chloride Traditional Name: [4-(butylamino)-5,6-dimethyl-s-triazin-5-ium-2-yl]-ethyl-phenyl-amine chloride Formula: C17H26ClN5 MolecularWeight: 335.87484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=[N+](C(=NC(=N1)N(CC)C2=CC=CC=C2)C)C.[Cl-]

Isomeric SMILES

CCCCNC1=[N+](C(=NC(=N1)N(CC)C2=CC=CC=C2)C)C.[Cl-]

InChI

InChI=1S/C17H25N5.ClH/c1-5-7-13-18-16-20-17(19-14(3)21(16)4)22(6-2)15-11-9-8-10-12-15;/h8-12H,5-7,13H2,1-4H3;1H