6-(3,5-dimethylphenoxy)-5-nitro-N-propan-2-yl-pyrimidin-4-amine

Systemtic Name: 6-(3,5-dimethylphenoxy)-5-nitro-N-propan-2-yl-pyrimidin-4-amine Openeye Name: 6-(3,5-dimethylphenoxy)-N-isopropyl-5-nitro-pyrimidin-4-amine CAS Name: 6-(3,5-dimethylphenoxy)-5-nitro-N-propan-2-yl-4-pyrimidinamine IUPAC Name: 6-(3,5-dimethylphenoxy)-5-nitro-N-propan-2-ylpyrimidin-4-amine Traditional Name: [6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-yl]-isopropyl-amine Formula: C15H18N4O3 MolecularWeight: 302.32842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N4O3/c1-9(2)18-14-13(19(20)21)15(17-8-16-14)22-12-6-10(3)5-11(4)7-12/h5-9H,1-4H3,(H,16,17,18)