4-(3-azanylpropylamino)-3-nitro-benzenecarbonitrile hydrochloride

Systemtic Name: 4-(3-azanylpropylamino)-3-nitro-benzenecarbonitrile hydrochloride Openeye Name: 4-(3-aminopropylamino)-3-nitro-benzonitrile hydrochloride CAS Name: 4-(3-aminopropylamino)-3-nitrobenzonitrile hydrochloride IUPAC Name: 4-(3-aminopropylamino)-3-nitrobenzonitrile hydrochloride Traditional Name: 4-(3-aminopropylamino)-3-nitro-benzonitrile hydrochloride Formula: C10H13ClN4O2 MolecularWeight: 256.68882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)[N+](=O)[O-])NCCCN.Cl

Isomeric SMILES

C1=CC(=C(C=C1C#N)[N+](=O)[O-])NCCCN.Cl

InChI

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