5-nitro-N4-(3-nitrophenyl)-N6-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4-(3-nitrophenyl)-N6-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine Openeye Name: 5-nitro-N4-(3-nitrophenyl)-N6-(tetrahydrofuran-2-ylmethyl)pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-(3-nitrophenyl)-N6-(2-oxolanylmethyl)pyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N-(3-nitrophenyl)-6-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine Traditional Name: [5-nitro-6-(3-nitroanilino)pyrimidin-4-yl]-(tetrahydrofurfuryl)amine Formula: C15H16N6O5 MolecularWeight: 360.32474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC(OC1)CNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H16N6O5/c22-20(23)11-4-1-3-10(7-11)19-15-13(21(24)25)14(17-9-18-15)16-8-12-5-2-6-26-12/h1,3-4,7,9,12H,2,5-6,8H2,(H2,16,17,18,19)