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

Systemtic Name: 4-(2-chloranyl-5-nitro-pyrimidin-4-yl)oxy-3,5-dimethyl-benzenecarbonitrile Openeye Name: 4-(2-chloro-5-nitro-pyrimidin-4-yl)oxy-3,5-dimethyl-benzonitrile CAS Name: 4-[(2-chloro-5-nitro-4-pyrimidinyl)oxy]-3,5-dimethylbenzonitrile IUPAC Name: 4-(2-chloro-5-nitropyrimidin-4-yl)oxy-3,5-dimethylbenzonitrile Traditional Name: 4-(2-chloro-5-nitro-pyrimidin-4-yl)oxy-3,5-dimethyl-benzonitrile Formula: C13H9ClN4O3 MolecularWeight: 304.68856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=NC(=NC=C2[N+](=O)[O-])Cl)C)C#N

Isomeric SMILES

CC1=CC(=CC(=C1OC2=NC(=NC=C2[N+](=O)[O-])Cl)C)C#N

InChI

InChI=1S/C13H9ClN4O3/c1-7-3-9(5-15)4-8(2)11(7)21-12-10(18(19)20)6-16-13(14)17-12/h3-4,6H,1-2H3