1-[3-[(6-naphthalen-2-yloxy-5-nitro-pyrimidin-4-yl)amino]phenyl]ethanone

Systemtic Name: 1-[3-[(6-naphthalen-2-yloxy-5-nitro-pyrimidin-4-yl)amino]phenyl]ethanone Openeye Name: 1-[3-[[6-(2-naphthyloxy)-5-nitro-pyrimidin-4-yl]amino]phenyl]ethanone CAS Name: 1-[3-[[6-(2-naphthalenyloxy)-5-nitro-4-pyrimidinyl]amino]phenyl]ethanone IUPAC Name: 1-[3-[(6-naphthalen-2-yloxy-5-nitropyrimidin-4-yl)amino]phenyl]ethanone Traditional Name: 1-[3-[[6-(2-naphthoxy)-5-nitro-pyrimidin-4-yl]amino]phenyl]ethanone Formula: C22H16N4O4 MolecularWeight: 400.38684

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC2=C(C(=NC=N2)OC3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC2=C(C(=NC=N2)OC3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O4/c1-14(27)16-7-4-8-18(11-16)25-21-20(26(28)29)22(24-13-23-21)30-19-10-9-15-5-2-3-6-17(15)12-19/h2-13H,1H3,(H,23,24,25)