4-(2-nitrobutan-2-yl)benzenecarbonitrile

Systemtic Name: 4-(2-nitrobutan-2-yl)benzenecarbonitrile Openeye Name: 4-(1-methyl-1-nitro-propyl)benzonitrile CAS Name: 4-(2-nitrobutan-2-yl)benzonitrile IUPAC Name: 4-(2-nitrobutan-2-yl)benzonitrile Traditional Name: 4-(1-methyl-1-nitro-propyl)benzonitrile Formula: C11H12N2O2 MolecularWeight: 204.22518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O2/c1-3-11(2,13(14)15)10-6-4-9(8-12)5-7-10/h4-7H,3H2,1-2H3