6-[[4-octoxy-6-[(6-oxidanyl-6-oxidanylidene-hexyl)amino]-1,3,5-triazin-2-yl]amino]hexanoic acid

Systemtic Name: 6-[[4-octoxy-6-[(6-oxidanyl-6-oxidanylidene-hexyl)amino]-1,3,5-triazin-2-yl]amino]hexanoic acid Openeye Name: 6-[[4-[(6-hydroxy-6-oxo-hexyl)amino]-6-octoxy-1,3,5-triazin-2-yl]amino]hexanoic acid CAS Name: 6-[[4-[(6-hydroxy-6-oxohexyl)amino]-6-octoxy-1,3,5-triazin-2-yl]amino]hexanoic acid IUPAC Name: 6-[[4-[(6-hydroxy-6-oxohexyl)amino]-6-octoxy-1,3,5-triazin-2-yl]amino]hexanoic acid Traditional Name: 6-[[4-[(6-hydroxy-6-keto-hexyl)amino]-6-octoxy-s-triazin-2-yl]amino]hexanoic acid Formula: C23H41N5O5 MolecularWeight: 467.60214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=NC(=NC(=N1)NCCCCCC(=O)O)NCCCCCC(=O)O

Isomeric SMILES

CCCCCCCCOC1=NC(=NC(=N1)NCCCCCC(=O)O)NCCCCCC(=O)O

InChI

InChI=1S/C23H41N5O5/c1-2-3-4-5-6-13-18-33-23-27-21(24-16-11-7-9-14-19(29)30)26-22(28-23)25-17-12-8-10-15-20(31)32/h2-18H2,1H3,(H,29,30)(H,31,32)(H2,24,25,26,27,28)