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

Systemtic Name: N6-(2,3-dihydro-1,4-benzodioxin-6-yl)-N4-(2-fluorophenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-(2,3-dihydro-1,4-benzodioxin-6-yl)-N4-(2-fluorophenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(2,3-dihydro-1,4-benzodioxin-6-yl)-N4-(2-fluorophenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-N-(2-fluorophenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[6-(2-fluoroanilino)-5-nitro-pyrimidin-4-yl]amine Formula: C18H14FN5O4 MolecularWeight: 383.333263

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC3=C(C(=NC=N3)NC4=CC=CC=C4F)[N+](=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC3=C(C(=NC=N3)NC4=CC=CC=C4F)[N+](=O)[O-]

InChI

InChI=1S/C18H14FN5O4/c19-12-3-1-2-4-13(12)23-18-16(24(25)26)17(20-10-21-18)22-11-5-6-14-15(9-11)28-8-7-27-14/h1-6,9-10H,7-8H2,(H2,20,21,22,23)