1-[3-[(5-nitro-6-pyridin-3-yloxy-pyrimidin-4-yl)amino]phenyl]ethanone

Systemtic Name: 1-[3-[(5-nitro-6-pyridin-3-yloxy-pyrimidin-4-yl)amino]phenyl]ethanone Openeye Name: 1-[3-[[5-nitro-6-(3-pyridyloxy)pyrimidin-4-yl]amino]phenyl]ethanone CAS Name: 1-[3-[[5-nitro-6-(3-pyridinyloxy)-4-pyrimidinyl]amino]phenyl]ethanone IUPAC Name: 1-[3-[(5-nitro-6-pyridin-3-yloxypyrimidin-4-yl)amino]phenyl]ethanone Traditional Name: 1-[3-[[5-nitro-6-(3-pyridyloxy)pyrimidin-4-yl]amino]phenyl]ethanone Formula: C17H13N5O4 MolecularWeight: 351.31622

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC2=C(C(=NC=N2)OC3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC2=C(C(=NC=N2)OC3=CN=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N5O4/c1-11(23)12-4-2-5-13(8-12)21-16-15(22(24)25)17(20-10-19-16)26-14-6-3-7-18-9-14/h2-10H,1H3,(H,19,20,21)