4-chloranyl-3-(2-methoxy-5-nitro-pyrimidin-4-yl)oxy-benzenecarbonitrile

Systemtic Name: 4-chloranyl-3-(2-methoxy-5-nitro-pyrimidin-4-yl)oxy-benzenecarbonitrile Openeye Name: 4-chloro-3-(2-methoxy-5-nitro-pyrimidin-4-yl)oxy-benzonitrile CAS Name: 4-chloro-3-[(2-methoxy-5-nitro-4-pyrimidinyl)oxy]benzonitrile IUPAC Name: 4-chloro-3-(2-methoxy-5-nitropyrimidin-4-yl)oxybenzonitrile Traditional Name: 4-chloro-3-(2-methoxy-5-nitro-pyrimidin-4-yl)oxy-benzonitrile Formula: C12H7ClN4O4 MolecularWeight: 306.66138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C(=N1)OC2=C(C=CC(=C2)C#N)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=NC=C(C(=N1)OC2=C(C=CC(=C2)C#N)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H7ClN4O4/c1-20-12-15-6-9(17(18)19)11(16-12)21-10-4-7(5-14)2-3-8(10)13/h2-4,6H,1H3