N-(1,3-benzodioxol-5-ylmethyl)-5-nitro-6-propan-2-yloxy-pyrimidin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-nitro-6-propan-2-yloxy-pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6-isopropoxy-5-nitro-pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-nitro-6-propan-2-yloxy-4-pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-nitro-6-propan-2-yloxypyrimidin-4-amine Traditional Name: (6-isopropoxy-5-nitro-pyrimidin-4-yl)-piperonyl-amine Formula: C15H16N4O5 MolecularWeight: 332.31134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NC=NC(=C1[N+](=O)[O-])NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)OC1=NC=NC(=C1[N+](=O)[O-])NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H16N4O5/c1-9(2)24-15-13(19(20)21)14(17-7-18-15)16-6-10-3-4-11-12(5-10)23-8-22-11/h3-5,7,9H,6,8H2,1-2H3,(H,16,17,18)