N1-(4-azanylbutyl)-4-nitro-benzene-1,3-diamine hydrochloride

Systemtic Name: N1-(4-azanylbutyl)-4-nitro-benzene-1,3-diamine hydrochloride Openeye Name: N1-(4-aminobutyl)-4-nitro-benzene-1,3-diamine hydrochloride CAS Name: N1-(4-aminobutyl)-4-nitrobenzene-1,3-diamine hydrochloride IUPAC Name: 1-N-(4-aminobutyl)-4-nitrobenzene-1,3-diamine hydrochloride Traditional Name: 4-aminobutyl-(3-amino-4-nitro-phenyl)amine hydrochloride Formula: C10H17ClN4O2 MolecularWeight: 260.72058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NCCCCN)N)[N+](=O)[O-].Cl

Isomeric SMILES

C1=CC(=C(C=C1NCCCCN)N)[N+](=O)[O-].Cl

InChI

InChI=1S/C10H16N4O2.ClH/c11-5-1-2-6-13-8-3-4-10(14(15)16)9(12)7-8;/h3-4,7,13H,1-2,5-6,11-12H2;1H