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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(2-tert-butylhydrazinyl)-5-nitro-pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(2-tert-butylhydrazino)-5-nitro-pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(tert-butylhydrazo)-5-nitro-4-pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(2-tert-butylhydrazinyl)-5-nitropyrimidin-4-amine Traditional Name: [6-(N'-tert-butylhydrazino)-5-nitro-pyrimidin-4-yl]-piperonyl-amine Formula: C16H20N6O4 MolecularWeight: 360.3678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NNC1=NC=NC(=C1[N+](=O)[O-])NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)NNC1=NC=NC(=C1[N+](=O)[O-])NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H20N6O4/c1-16(2,3)21-20-15-13(22(23)24)14(18-8-19-15)17-7-10-4-5-11-12(6-10)26-9-25-11/h4-6,8,21H,7,9H2,1-3H3,(H2,17,18,19,20)