ethanedioic acid; 3-pyrimidin-2-ylpropane-1,2-diamine

Systemtic Name: ethanedioic acid; 3-pyrimidin-2-ylpropane-1,2-diamine Openeye Name: oxalic acid; 3-pyrimidin-2-ylpropane-1,2-diamine CAS Name: oxalic acid; 3-(2-pyrimidinyl)propane-1,2-diamine IUPAC Name: oxalic acid; 3-pyrimidin-2-ylpropane-1,2-diamine Traditional Name: [1-(aminomethyl)-2-(2-pyrimidyl)ethyl]amine; oxalic acid Formula: C11H16N4O8 MolecularWeight: 332.26674

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)CC(CN)N.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CN=C(N=C1)CC(CN)N.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C7H12N4.2C2H2O4/c8-5-6(9)4-7-10-2-1-3-11-7;2*3-1(4)2(5)6/h1-3,6H,4-5,8-9H2;2*(H,3,4)(H,5,6)