2-(2,2-dimethylpropoxy)-5-nitro-benzenecarbonitrile

Systemtic Name: 2-(2,2-dimethylpropoxy)-5-nitro-benzenecarbonitrile Openeye Name: 2-(2,2-dimethylpropoxy)-5-nitro-benzonitrile CAS Name: 2-(2,2-dimethylpropoxy)-5-nitrobenzonitrile IUPAC Name: 2-(2,2-dimethylpropoxy)-5-nitrobenzonitrile Traditional Name: 2-neopentyloxy-5-nitro-benzonitrile Formula: C12H14N2O3 MolecularWeight: 234.25116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)COC1=C(C=C(C=C1)[N+](=O)[O-])C#N

Isomeric SMILES

CC(C)(C)COC1=C(C=C(C=C1)[N+](=O)[O-])C#N

InChI

InChI=1S/C12H14N2O3/c1-12(2,3)8-17-11-5-4-10(14(15)16)6-9(11)7-13/h4-6H,8H2,1-3H3