6-ethoxy-5-nitro-N-(4-phenoxyphenyl)pyrimidin-4-amine

Systemtic Name: 6-ethoxy-5-nitro-N-(4-phenoxyphenyl)pyrimidin-4-amine Openeye Name: 6-ethoxy-5-nitro-N-(4-phenoxyphenyl)pyrimidin-4-amine CAS Name: 6-ethoxy-5-nitro-N-(4-phenoxyphenyl)-4-pyrimidinamine IUPAC Name: 6-ethoxy-5-nitro-N-(4-phenoxyphenyl)pyrimidin-4-amine Traditional Name: (6-ethoxy-5-nitro-pyrimidin-4-yl)-(4-phenoxyphenyl)amine Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CCOC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C18H16N4O4/c1-2-25-18-16(22(23)24)17(19-12-20-18)21-13-8-10-15(11-9-13)26-14-6-4-3-5-7-14/h3-12H,2H2,1H3,(H,19,20,21)