2-[(1,3,5-triazin-2-ylamino)methylamino]propanedioic acid

Systemtic Name: 2-[(1,3,5-triazin-2-ylamino)methylamino]propanedioic acid Openeye Name: 2-[(1,3,5-triazin-2-ylamino)methylamino]propanedioic acid CAS Name: 2-[(1,3,5-triazin-2-ylamino)methylamino]propanedioic acid IUPAC Name: 2-[(1,3,5-triazin-2-ylamino)methylamino]propanedioic acid Traditional Name: 2-[(s-triazin-2-ylamino)methylamino]malonic acid Formula: C7H9N5O4 MolecularWeight: 227.17746

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC=NC(=N1)NCNC(C(=O)O)C(=O)O

Isomeric SMILES

C1=NC=NC(=N1)NCNC(C(=O)O)C(=O)O

InChI

InChI=1S/C7H9N5O4/c13-5(14)4(6(15)16)9-3-12-7-10-1-8-2-11-7/h1-2,4,9H,3H2,(H,13,14)(H,15,16)(H,8,10,11,12)