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

Systemtic Name: 6-[[5-oxidanylidene-6-(phenylmethyl)-2H-1,2,4-triazin-3-yl]amino]hexylazanium Openeye Name: 6-[(6-benzyl-5-oxo-2H-1,2,4-triazin-3-yl)amino]hexylammonium CAS Name: 6-[[5-oxo-6-(phenylmethyl)-2H-1,2,4-triazin-3-yl]amino]hexylammonium IUPAC Name: 6-[(6-benzyl-5-oxo-2H-1,2,4-triazin-3-yl)amino]hexylazanium Traditional Name: 6-[(6-benzyl-5-keto-2H-1,2,4-triazin-3-yl)amino]hexylammonium Formula: C16H24N5O+ MolecularWeight: 302.39466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NNC(=NC2=O)NCCCCCC[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)CC2=NNC(=NC2=O)NCCCCCC[NH3+]

InChI

InChI=1S/C16H23N5O/c17-10-6-1-2-7-11-18-16-19-15(22)14(20-21-16)12-13-8-4-3-5-9-13/h3-5,8-9H,1-2,6-7,10-12,17H2,(H2,18,19,21,22)/p+1