3-[(4-cyano-2-nitro-phenyl)amino]propylazanium

Systemtic Name: 3-[(4-cyano-2-nitro-phenyl)amino]propylazanium Openeye Name: 3-(4-cyano-2-nitro-anilino)propylammonium CAS Name: 3-(4-cyano-2-nitroanilino)propylammonium IUPAC Name: 3-(4-cyano-2-nitroanilino)propylazanium Traditional Name: 3-(4-cyano-2-nitro-anilino)propylammonium Formula: C10H13N4O2+ MolecularWeight: 221.23582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)[N+](=O)[O-])NCCC[NH3+]

Isomeric SMILES

C1=CC(=C(C=C1C#N)[N+](=O)[O-])NCCC[NH3+]

InChI

InChI=1S/C10H12N4O2/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/p+1