(E)-azanyl-[2-(2-cyanoaziridin-1-yl)-2-oxidanylidene-ethyl]-(phenylmethylidene)azanium

Systemtic Name: (E)-azanyl-[2-(2-cyanoaziridin-1-yl)-2-oxidanylidene-ethyl]-(phenylmethylidene)azanium Openeye Name: (E)-amino-benzylidene-[2-(2-cyanoaziridin-1-yl)-2-oxo-ethyl]ammonium CAS Name: (E)-amino-[2-(2-cyano-1-aziridinyl)-2-oxoethyl]-(phenylmethylene)ammonium IUPAC Name: (E)-amino-benzylidene-[2-(2-cyanoaziridin-1-yl)-2-oxoethyl]azanium Traditional Name: (E)-amino-benzal-[2-(2-cyanoethylenimin-1-yl)-2-keto-ethyl]ammonium Formula: C12H13N4O+ MolecularWeight: 229.25782

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N1C(=O)C[N+](=CC2=CC=CC=C2)N)C#N

Isomeric SMILES

C1C(N1C(=O)C/[N+](=C\C2=CC=CC=C2)/N)C#N

InChI

InChI=1S/C12H13N4O/c13-6-11-8-16(11)12(17)9-15(14)7-10-4-2-1-3-5-10/h1-5,7,11H,8-9,14H2/q+1/b15-7+