ethanedioic acid; 1-ethyl-1-nitroso-3-(pyridin-3-ylmethyl)urea

Systemtic Name: ethanedioic acid; 1-ethyl-1-nitroso-3-(pyridin-3-ylmethyl)urea Openeye Name: 1-ethyl-1-nitroso-3-(3-pyridylmethyl)urea; oxalic acid CAS Name: 1-ethyl-1-nitroso-3-(3-pyridinylmethyl)urea; oxalic acid IUPAC Name: 1-ethyl-1-nitroso-3-(pyridin-3-ylmethyl)urea; oxalic acid Traditional Name: 1-ethyl-1-nitroso-3-(3-pyridylmethyl)urea; oxalic acid Formula: C11H14N4O6 MolecularWeight: 298.25206

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)NCC1=CN=CC=C1)N=O.C(=O)(C(=O)O)O

Isomeric SMILES

CCN(C(=O)NCC1=CN=CC=C1)N=O.C(=O)(C(=O)O)O

InChI

InChI=1S/C9H12N4O2.C2H2O4/c1-2-13(12-15)9(14)11-7-8-4-3-5-10-6-8;3-1(4)2(5)6/h3-6H,2,7H2,1H3,(H,11,14);(H,3,4)(H,5,6)