N-cyclohexyl-6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-cyclohexyl-6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-amine Openeye Name: N-cyclohexyl-6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-amine CAS Name: N-cyclohexyl-6-(3,5-dimethylphenoxy)-5-nitro-4-pyrimidinamine IUPAC Name: N-cyclohexyl-6-(3,5-dimethylphenoxy)-5-nitropyrimidin-4-amine Traditional Name: cyclohexyl-[6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3CCCCC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3CCCCC3)C

InChI

InChI=1S/C18H22N4O3/c1-12-8-13(2)10-15(9-12)25-18-16(22(23)24)17(19-11-20-18)21-14-6-4-3-5-7-14/h8-11,14H,3-7H2,1-2H3,(H,19,20,21)