1-[(E)-2-(2-aminocarbonylaziridin-1-yl)-2-nitroso-1-(oxidanylamino)ethenyl]aziridine-2-carboxamide

Systemtic Name: 1-[(E)-2-(2-aminocarbonylaziridin-1-yl)-2-nitroso-1-(oxidanylamino)ethenyl]aziridine-2-carboxamide Openeye Name: 1-[(E)-2-(2-carbamoylaziridin-1-yl)-1-(hydroxyamino)-2-nitroso-vinyl]aziridine-2-carboxamide CAS Name: 1-[(E)-2-(2-carbamoyl-1-aziridinyl)-1-(hydroxyamino)-2-nitrosoethenyl]-2-aziridinecarboxamide IUPAC Name: 1-[(E)-2-(2-carbamoylaziridin-1-yl)-1-(hydroxyamino)-2-nitrosoethenyl]aziridine-2-carboxamide Traditional Name: 1-[(E)-2-(2-carbamoylethylenimin-1-yl)-1-(hydroxyamino)-2-nitroso-vinyl]ethylenimine-2-carboxamide Formula: C8H12N6O4 MolecularWeight: 256.21868

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N1C(=C(N=O)N2CC2C(=O)N)NO)C(=O)N

Isomeric SMILES

C1C(N1/C(=C(\N=O)/N2CC2C(=O)N)/NO)C(=O)N

InChI

InChI=1S/C8H12N6O4/c9-5(15)3-1-13(3)7(11-17)8(12-18)14-2-4(14)6(10)16/h3-4,11,17H,1-2H2,(H2,9,15)(H2,10,16)/b8-7+