2-[4-(2-methylbutan-2-yl)phenoxy]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[4-(2-methylbutan-2-yl)phenoxy]-5-nitro-benzenecarbonitrile Openeye Name: 2-[4-(1,1-dimethylpropyl)phenoxy]-5-nitro-benzonitrile CAS Name: 2-[4-(2-methylbutan-2-yl)phenoxy]-5-nitrobenzonitrile IUPAC Name: 2-[4-(2-methylbutan-2-yl)phenoxy]-5-nitrobenzonitrile Traditional Name: 2-(4-tert-amylphenoxy)-5-nitro-benzonitrile Formula: C18H18N2O3 MolecularWeight: 310.34712

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C18H18N2O3/c1-4-18(2,3)14-5-8-16(9-6-14)23-17-10-7-15(20(21)22)11-13(17)12-19/h5-11H,4H2,1-3H3