4-(cyanomethyl)-5-methyl-2-nitro-benzenecarbonitrile

Systemtic Name: 4-(cyanomethyl)-5-methyl-2-nitro-benzenecarbonitrile Openeye Name: 4-(cyanomethyl)-5-methyl-2-nitro-benzonitrile CAS Name: 4-(cyanomethyl)-5-methyl-2-nitrobenzonitrile IUPAC Name: 4-(cyanomethyl)-5-methyl-2-nitrobenzonitrile Traditional Name: 4-(cyanomethyl)-5-methyl-2-nitro-benzonitrile Formula: C10H7N3O2 MolecularWeight: 201.18148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)C#N)[N+](=O)[O-])CC#N

Isomeric SMILES

CC1=C(C=C(C(=C1)C#N)[N+](=O)[O-])CC#N

InChI

InChI=1S/C10H7N3O2/c1-7-4-9(6-12)10(13(14)15)5-8(7)2-3-11/h4-5H,2H2,1H3