dimethyl (E)-2-(2-cyanoaziridin-1-yl)but-2-enedioate

Systemtic Name: dimethyl (E)-2-(2-cyanoaziridin-1-yl)but-2-enedioate Openeye Name: dimethyl (E)-2-(2-cyanoaziridin-1-yl)but-2-enedioate CAS Name: (E)-2-(2-cyano-1-aziridinyl)-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (E)-2-(2-cyanoaziridin-1-yl)but-2-enedioate Traditional Name: (E)-2-(2-cyanoethylenimin-1-yl)but-2-enedioic acid dimethyl ester Formula: C9H10N2O4 MolecularWeight: 210.1867

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C(C(=O)OC)N1CC1C#N

Isomeric SMILES

COC(=O)/C=C(\C(=O)OC)/N1CC1C#N

InChI

InChI=1S/C9H10N2O4/c1-14-8(12)3-7(9(13)15-2)11-5-6(11)4-10/h3,6H,5H2,1-2H3/b7-3+