1-[4-[[(6-azanyl-5-nitro-pyridin-2-yl)amino]methyl]phenyl]ethanone

Systemtic Name: 1-[4-[[(6-azanyl-5-nitro-pyridin-2-yl)amino]methyl]phenyl]ethanone Openeye Name: 1-[4-[[(6-amino-5-nitro-2-pyridyl)amino]methyl]phenyl]ethanone CAS Name: 1-[4-[[(6-amino-5-nitro-2-pyridinyl)amino]methyl]phenyl]ethanone IUPAC Name: 1-[4-[[(6-amino-5-nitropyridin-2-yl)amino]methyl]phenyl]ethanone Traditional Name: 1-[4-[[(6-amino-5-nitro-2-pyridyl)amino]methyl]phenyl]ethanone Formula: C14H14N4O3 MolecularWeight: 286.28596

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)CNC2=NC(=C(C=C2)[N+](=O)[O-])N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)CNC2=NC(=C(C=C2)[N+](=O)[O-])N

InChI

InChI=1S/C14H14N4O3/c1-9(19)11-4-2-10(3-5-11)8-16-13-7-6-12(18(20)21)14(15)17-13/h2-7H,8H2,1H3,(H3,15,16,17)