3-(butylamino)-4-nitro-benzenecarbonitrile

Systemtic Name: 3-(butylamino)-4-nitro-benzenecarbonitrile Openeye Name: 3-(butylamino)-4-nitro-benzonitrile CAS Name: 3-(butylamino)-4-nitrobenzonitrile IUPAC Name: 3-(butylamino)-4-nitrobenzonitrile Traditional Name: 3-(butylamino)-4-nitro-benzonitrile Formula: C11H13N3O2 MolecularWeight: 219.23982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=CC(=C1)C#N)[N+](=O)[O-]

Isomeric SMILES

CCCCNC1=C(C=CC(=C1)C#N)[N+](=O)[O-]

InChI

InChI=1S/C11H13N3O2/c1-2-3-6-13-10-7-9(8-12)4-5-11(10)14(15)16/h4-5,7,13H,2-3,6H2,1H3