2-[[4-[[(5-nitropyridin-2-yl)amino]methyl]phenyl]carbonylamino]ethylazanium

Systemtic Name: 2-[[4-[[(5-nitropyridin-2-yl)amino]methyl]phenyl]carbonylamino]ethylazanium Openeye Name: 2-[[4-[[(5-nitro-2-pyridyl)amino]methyl]benzoyl]amino]ethylammonium CAS Name: 2-[[[4-[[(5-nitro-2-pyridinyl)amino]methyl]phenyl]-oxomethyl]amino]ethylammonium IUPAC Name: 2-[[4-[[(5-nitropyridin-2-yl)amino]methyl]benzoyl]amino]ethylazanium Traditional Name: 2-[[4-[[(5-nitro-2-pyridyl)amino]methyl]benzoyl]amino]ethylammonium Formula: C15H18N5O3+ MolecularWeight: 316.33512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=NC=C(C=C2)[N+](=O)[O-])C(=O)NCC[NH3+]

Isomeric SMILES

C1=CC(=CC=C1CNC2=NC=C(C=C2)[N+](=O)[O-])C(=O)NCC[NH3+]

InChI

InChI=1S/C15H17N5O3/c16-7-8-17-15(21)12-3-1-11(2-4-12)9-18-14-6-5-13(10-19-14)20(22)23/h1-6,10H,7-9,16H2,(H,17,21)(H,18,19)/p+1