N4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N6-ethyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N6-ethyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N6-ethyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N6-ethyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-N-ethyl-5-nitropyrimidine-4,6-diamine Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[6-(ethylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C14H15N5O4 MolecularWeight: 317.3

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC=NC(=C1[N+](=O)[O-])NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCNC1=NC=NC(=C1[N+](=O)[O-])NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C14H15N5O4/c1-2-15-13-12(19(20)21)14(17-8-16-13)18-9-3-4-10-11(7-9)23-6-5-22-10/h3-4,7-8H,2,5-6H2,1H3,(H2,15,16,17,18)