2-[(4-chlorophenyl)-cyano-methyl]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[(4-chlorophenyl)-cyano-methyl]-5-nitro-benzenecarbonitrile Openeye Name: 2-[(4-chlorophenyl)-cyano-methyl]-5-nitro-benzonitrile CAS Name: 2-[(4-chlorophenyl)-cyanomethyl]-5-nitrobenzonitrile IUPAC Name: 2-[(4-chlorophenyl)-cyanomethyl]-5-nitrobenzonitrile Traditional Name: 2-[(4-chlorophenyl)-cyano-methyl]-5-nitro-benzonitrile Formula: C15H8ClN3O2 MolecularWeight: 297.69592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C#N)C2=C(C=C(C=C2)[N+](=O)[O-])C#N)Cl

Isomeric SMILES

C1=CC(=CC=C1C(C#N)C2=C(C=C(C=C2)[N+](=O)[O-])C#N)Cl

InChI

InChI=1S/C15H8ClN3O2/c16-12-3-1-10(2-4-12)15(9-18)14-6-5-13(19(20)21)7-11(14)8-17/h1-7,15H