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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

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/p+1