5-(aziridin-1-yl)-2,4-dinitro-benzenecarbonitrile

Systemtic Name: 5-(aziridin-1-yl)-2,4-dinitro-benzenecarbonitrile Openeye Name: 5-(aziridin-1-yl)-2,4-dinitro-benzonitrile CAS Name: 5-(1-aziridinyl)-2,4-dinitrobenzonitrile IUPAC Name: 5-(aziridin-1-yl)-2,4-dinitrobenzonitrile Traditional Name: 5-ethylenimino-2,4-dinitro-benzonitrile Formula: C9H6N4O4 MolecularWeight: 234.16834

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Descriptors Computed from Structure

Canonical SMILES:

C1CN1C2=C(C=C(C(=C2)C#N)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CN1C2=C(C=C(C(=C2)C#N)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H6N4O4/c10-5-6-3-8(11-1-2-11)9(13(16)17)4-7(6)12(14)15/h3-4H,1-2H2