6-[[6-(3,4-dimethylphenyl)-5-oxidanylidene-2H-1,2,4-triazin-3-yl]amino]hexylazanium

Systemtic Name: 6-[[6-(3,4-dimethylphenyl)-5-oxidanylidene-2H-1,2,4-triazin-3-yl]amino]hexylazanium Openeye Name: 6-[[6-(3,4-dimethylphenyl)-5-oxo-2H-1,2,4-triazin-3-yl]amino]hexylammonium CAS Name: 6-[[6-(3,4-dimethylphenyl)-5-oxo-2H-1,2,4-triazin-3-yl]amino]hexylammonium IUPAC Name: 6-[[6-(3,4-dimethylphenyl)-5-oxo-2H-1,2,4-triazin-3-yl]amino]hexylazanium Traditional Name: 6-[[6-(3,4-dimethylphenyl)-5-keto-2H-1,2,4-triazin-3-yl]amino]hexylammonium Formula: C17H26N5O+ MolecularWeight: 316.42124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NNC(=NC2=O)NCCCCCC[NH3+])C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NNC(=NC2=O)NCCCCCC[NH3+])C

InChI

InChI=1S/C17H25N5O/c1-12-7-8-14(11-13(12)2)15-16(23)20-17(22-21-15)19-10-6-4-3-5-9-18/h7-8,11H,3-6,9-10,18H2,1-2H3,(H2,19,20,22,23)/p+1