2-(2-butyl-3-nitro-phenyl)butanenitrile

Systemtic Name: 2-(2-butyl-3-nitro-phenyl)butanenitrile Openeye Name: 2-(2-butyl-3-nitro-phenyl)butanenitrile CAS Name: 2-(2-butyl-3-nitrophenyl)butanenitrile IUPAC Name: 2-(2-butyl-3-nitrophenyl)butanenitrile Traditional Name: 2-(2-butyl-3-nitro-phenyl)butyronitrile Formula: C14H18N2O2 MolecularWeight: 246.30492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC=C1[N+](=O)[O-])C(CC)C#N

Isomeric SMILES

CCCCC1=C(C=CC=C1[N+](=O)[O-])C(CC)C#N

InChI

InChI=1S/C14H18N2O2/c1-3-5-7-13-12(11(4-2)10-15)8-6-9-14(13)16(17)18/h6,8-9,11H,3-5,7H2,1-2H3