2-(2-methylpropyl)-5-nitro-benzenecarbonitrile

Systemtic Name: 2-(2-methylpropyl)-5-nitro-benzenecarbonitrile Openeye Name: 2-isobutyl-5-nitro-benzonitrile CAS Name: 2-(2-methylpropyl)-5-nitrobenzonitrile IUPAC Name: 2-(2-methylpropyl)-5-nitrobenzonitrile Traditional Name: 2-isobutyl-5-nitro-benzonitrile Formula: C11H12N2O2 MolecularWeight: 204.22518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C=C(C=C1)[N+](=O)[O-])C#N

Isomeric SMILES

CC(C)CC1=C(C=C(C=C1)[N+](=O)[O-])C#N

InChI

InChI=1S/C11H12N2O2/c1-8(2)5-9-3-4-11(13(14)15)6-10(9)7-12/h3-4,6,8H,5H2,1-2H3