2-[4-[6-[(2-nitrophenyl)methyl]-5-oxidanylidene-2H-1,2,4-triazin-3-yl]piperazin-1-yl]ethylazanium

Systemtic Name: 2-[4-[6-[(2-nitrophenyl)methyl]-5-oxidanylidene-2H-1,2,4-triazin-3-yl]piperazin-1-yl]ethylazanium Openeye Name: 2-[4-[6-[(2-nitrophenyl)methyl]-5-oxo-2H-1,2,4-triazin-3-yl]piperazin-1-yl]ethylammonium CAS Name: 2-[4-[6-[(2-nitrophenyl)methyl]-5-oxo-2H-1,2,4-triazin-3-yl]-1-piperazinyl]ethylammonium IUPAC Name: 2-[4-[6-[(2-nitrophenyl)methyl]-5-oxo-2H-1,2,4-triazin-3-yl]piperazin-1-yl]ethylazanium Traditional Name: 2-[4-[5-keto-6-(2-nitrobenzyl)-2H-1,2,4-triazin-3-yl]piperazino]ethylammonium Formula: C16H22N7O3+ MolecularWeight: 360.39098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC[NH3+])C2=NC(=O)C(=NN2)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC[NH3+])C2=NC(=O)C(=NN2)CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C16H21N7O3/c17-5-6-21-7-9-22(10-8-21)16-18-15(24)13(19-20-16)11-12-3-1-2-4-14(12)23(25)26/h1-4H,5-11,17H2,(H,18,20,24)/p+1