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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(2,6-dimethyl-4-morpholinyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine Traditional Name: [6-(2,6-dimethylmorpholino)-5-nitro-pyrimidin-4-yl]-piperonyl-amine Formula: C18H21N5O5 MolecularWeight: 387.38984

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C2=C(C(=NC=N2)NCC3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CC(O1)C)C2=C(C(=NC=N2)NCC3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

InChI

InChI=1S/C18H21N5O5/c1-11-7-22(8-12(2)28-11)18-16(23(24)25)17(20-9-21-18)19-6-13-3-4-14-15(5-13)27-10-26-14/h3-5,9,11-12H,6-8,10H2,1-2H3,(H,19,20,21)