5-chloranyl-2,4-dinitro-benzenecarbonitrile

Systemtic Name: 5-chloranyl-2,4-dinitro-benzenecarbonitrile Openeye Name: 5-chloro-2,4-dinitro-benzonitrile CAS Name: 5-chloro-2,4-dinitrobenzonitrile IUPAC Name: 5-chloro-2,4-dinitrobenzonitrile Traditional Name: 5-chloro-2,4-dinitro-benzonitrile Formula: C7H2ClN3O4 MolecularWeight: 227.56148

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1Cl)[N+](=O)[O-])[N+](=O)[O-])C#N

Isomeric SMILES

C1=C(C(=CC(=C1Cl)[N+](=O)[O-])[N+](=O)[O-])C#N

InChI

InChI=1S/C7H2ClN3O4/c8-5-1-4(3-9)6(10(12)13)2-7(5)11(14)15/h1-2H