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

Systemtic Name: N-cyclopentyl-6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-amine Openeye Name: N-cyclopentyl-6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-amine CAS Name: N-cyclopentyl-6-(3,5-dimethylphenoxy)-5-nitro-4-pyrimidinamine IUPAC Name: N-cyclopentyl-6-(3,5-dimethylphenoxy)-5-nitropyrimidin-4-amine Traditional Name: cyclopentyl-[6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C17H20N4O3 MolecularWeight: 328.3657

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3CCCC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3CCCC3)C

InChI

InChI=1S/C17H20N4O3/c1-11-7-12(2)9-14(8-11)24-17-15(21(22)23)16(18-10-19-17)20-13-5-3-4-6-13/h7-10,13H,3-6H2,1-2H3,(H,18,19,20)