3-(cyanomethyl)-6-nitro-2-propyl-benzenecarbonitrile

Systemtic Name: 3-(cyanomethyl)-6-nitro-2-propyl-benzenecarbonitrile Openeye Name: 3-(cyanomethyl)-6-nitro-2-propyl-benzonitrile CAS Name: 3-(cyanomethyl)-6-nitro-2-propylbenzonitrile IUPAC Name: 3-(cyanomethyl)-6-nitro-2-propylbenzonitrile Traditional Name: 3-(cyanomethyl)-6-nitro-2-propyl-benzonitrile Formula: C12H11N3O2 MolecularWeight: 229.23464

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1C#N)[N+](=O)[O-])CC#N

Isomeric SMILES

CCCC1=C(C=CC(=C1C#N)[N+](=O)[O-])CC#N

InChI

InChI=1S/C12H11N3O2/c1-2-3-10-9(6-7-13)4-5-12(15(16)17)11(10)8-14/h4-5H,2-3,6H2,1H3