N-[2-(2-cyanoaziridin-1-yl)-2-oxidanylidene-ethyl]-1-methyl-3-nitro-pyrazole-4-carboxamide

Systemtic Name: N-[2-(2-cyanoaziridin-1-yl)-2-oxidanylidene-ethyl]-1-methyl-3-nitro-pyrazole-4-carboxamide Openeye Name: N-[2-(2-cyanoaziridin-1-yl)-2-oxo-ethyl]-1-methyl-3-nitro-pyrazole-4-carboxamide CAS Name: N-[2-(2-cyano-1-aziridinyl)-2-oxoethyl]-1-methyl-3-nitro-4-pyrazolecarboxamide IUPAC Name: N-[2-(2-cyanoaziridin-1-yl)-2-oxoethyl]-1-methyl-3-nitropyrazole-4-carboxamide Traditional Name: N-[2-(2-cyanoethylenimin-1-yl)-2-keto-ethyl]-1-methyl-3-nitro-pyrazole-4-carboxamide Formula: C10H10N6O4 MolecularWeight: 278.2242

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)[N+](=O)[O-])C(=O)NCC(=O)N2CC2C#N

Isomeric SMILES

CN1C=C(C(=N1)[N+](=O)[O-])C(=O)NCC(=O)N2CC2C#N

InChI

InChI=1S/C10H10N6O4/c1-14-5-7(9(13-14)16(19)20)10(18)12-3-8(17)15-4-6(15)2-11/h5-6H,3-4H2,1H3,(H,12,18)