6-(4-ethylphenoxy)-5-nitro-N-(oxolan-2-ylmethyl)pyrimidin-4-amine

Systemtic Name: 6-(4-ethylphenoxy)-5-nitro-N-(oxolan-2-ylmethyl)pyrimidin-4-amine Openeye Name: 6-(4-ethylphenoxy)-5-nitro-N-(tetrahydrofuran-2-ylmethyl)pyrimidin-4-amine CAS Name: 6-(4-ethylphenoxy)-5-nitro-N-(2-oxolanylmethyl)-4-pyrimidinamine IUPAC Name: 6-(4-ethylphenoxy)-5-nitro-N-(oxolan-2-ylmethyl)pyrimidin-4-amine Traditional Name: [6-(4-ethylphenoxy)-5-nitro-pyrimidin-4-yl]-(tetrahydrofurfuryl)amine Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NCC3CCCO3

Isomeric SMILES

CCC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NCC3CCCO3

InChI

InChI=1S/C17H20N4O4/c1-2-12-5-7-13(8-6-12)25-17-15(21(22)23)16(19-11-20-17)18-10-14-4-3-9-24-14/h5-8,11,14H,2-4,9-10H2,1H3,(H,18,19,20)