N4-(1,3-benzodioxol-5-yl)-N6-(1,3-benzodioxol-5-ylmethyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-(1,3-benzodioxol-5-yl)-N6-(1,3-benzodioxol-5-ylmethyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(1,3-benzodioxol-5-yl)-N6-(1,3-benzodioxol-5-ylmethyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(1,3-benzodioxol-5-yl)-N6-(1,3-benzodioxol-5-ylmethyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(1,3-benzodioxol-5-yl)-6-N-(1,3-benzodioxol-5-ylmethyl)-5-nitropyrimidine-4,6-diamine Traditional Name: 1,3-benzodioxol-5-yl-[5-nitro-6-(piperonylamino)pyrimidin-4-yl]amine Formula: C19H15N5O6 MolecularWeight: 409.3523

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC=NC(=C3[N+](=O)[O-])NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC=NC(=C3[N+](=O)[O-])NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C19H15N5O6/c25-24(26)17-18(20-7-11-1-3-13-15(5-11)29-9-27-13)21-8-22-19(17)23-12-2-4-14-16(6-12)30-10-28-14/h1-6,8H,7,9-10H2,(H2,20,21,22,23)