5-[butyl(ethyl)amino]-2-nitro-benzenecarbonitrile

Systemtic Name: 5-[butyl(ethyl)amino]-2-nitro-benzenecarbonitrile Openeye Name: 5-[butyl(ethyl)amino]-2-nitro-benzonitrile CAS Name: 5-[butyl(ethyl)amino]-2-nitrobenzonitrile IUPAC Name: 5-[butyl(ethyl)amino]-2-nitrobenzonitrile Traditional Name: 5-[butyl(ethyl)amino]-2-nitro-benzonitrile Formula: C13H17N3O2 MolecularWeight: 247.29298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O2/c1-3-5-8-15(4-2)12-6-7-13(16(17)18)11(9-12)10-14/h6-7,9H,3-5,8H2,1-2H3