(2,3-dinitrophenyl) 2,6-bis(azanyl)hexanoate

Systemtic Name: (2,3-dinitrophenyl) 2,6-bis(azanyl)hexanoate Openeye Name: (2,3-dinitrophenyl) 2,6-diaminohexanoate CAS Name: 2,6-diaminohexanoic acid (2,3-dinitrophenyl) ester IUPAC Name: (2,3-dinitrophenyl) 2,6-diaminohexanoate Traditional Name: 2,6-diaminohexanoic acid (2,3-dinitrophenyl) ester Formula: C12H16N4O6 MolecularWeight: 312.27864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)OC(=O)C(CCCCN)N)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1)OC(=O)C(CCCCN)N)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H16N4O6/c13-7-2-1-4-8(14)12(17)22-10-6-3-5-9(15(18)19)11(10)16(20)21/h3,5-6,8H,1-2,4,7,13-14H2