2-(2-ethylbutylamino)-5-nitro-benzenecarbonitrile

Systemtic Name: 2-(2-ethylbutylamino)-5-nitro-benzenecarbonitrile Openeye Name: 2-(2-ethylbutylamino)-5-nitro-benzonitrile CAS Name: 2-(2-ethylbutylamino)-5-nitrobenzonitrile IUPAC Name: 2-(2-ethylbutylamino)-5-nitrobenzonitrile Traditional Name: 2-(2-ethylbutylamino)-5-nitro-benzonitrile Formula: C13H17N3O2 MolecularWeight: 247.29298

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CNC1=C(C=C(C=C1)[N+](=O)[O-])C#N

Isomeric SMILES

CCC(CC)CNC1=C(C=C(C=C1)[N+](=O)[O-])C#N

InChI

InChI=1S/C13H17N3O2/c1-3-10(4-2)9-15-13-6-5-12(16(17)18)7-11(13)8-14/h5-7,10,15H,3-4,9H2,1-2H3