4-(2,2-dimethylpropoxy)-3-nitro-benzenecarbonitrile

Systemtic Name: 4-(2,2-dimethylpropoxy)-3-nitro-benzenecarbonitrile Openeye Name: 4-(2,2-dimethylpropoxy)-3-nitro-benzonitrile CAS Name: 4-(2,2-dimethylpropoxy)-3-nitrobenzonitrile IUPAC Name: 4-(2,2-dimethylpropoxy)-3-nitrobenzonitrile Traditional Name: 4-neopentyloxy-3-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)C#N)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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