2-(3-azanylpropylamino)-5-nitro-benzenecarbonitrile

Systemtic Name: 2-(3-azanylpropylamino)-5-nitro-benzenecarbonitrile Openeye Name: 2-(3-aminopropylamino)-5-nitro-benzonitrile CAS Name: 2-(3-aminopropylamino)-5-nitrobenzonitrile IUPAC Name: 2-(3-aminopropylamino)-5-nitrobenzonitrile Traditional Name: 2-(3-aminopropylamino)-5-nitro-benzonitrile Formula: C10H12N4O2 MolecularWeight: 220.22788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12N4O2/c11-4-1-5-13-10-3-2-9(14(15)16)6-8(10)7-12/h2-3,6,13H,1,4-5,11H2