3-[4,6-bis(azanyl)-1,3,5-triazin-2-yl]butan-2-ylphosphonic acid

Systemtic Name: 3-[4,6-bis(azanyl)-1,3,5-triazin-2-yl]butan-2-ylphosphonic acid Openeye Name: [2-(4,6-diamino-1,3,5-triazin-2-yl)-1-methyl-propyl]phosphonic acid CAS Name: 3-(4,6-diamino-1,3,5-triazin-2-yl)butan-2-ylphosphonic acid IUPAC Name: 3-(4,6-diamino-1,3,5-triazin-2-yl)butan-2-ylphosphonic acid Traditional Name: [2-(4,6-diamino-s-triazin-2-yl)-1-methyl-propyl]phosphonic acid Formula: C7H14N5O3P MolecularWeight: 247.191521

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NC(=N1)N)N)C(C)P(=O)(O)O

Isomeric SMILES

CC(C1=NC(=NC(=N1)N)N)C(C)P(=O)(O)O

InChI

InChI=1S/C7H14N5O3P/c1-3(4(2)16(13,14)15)5-10-6(8)12-7(9)11-5/h3-4H,1-2H3,(H2,13,14,15)(H4,8,9,10,11,12)