N-(1,3-benzodioxol-5-yl)-6-cyclohexyloxy-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-yl)-6-cyclohexyloxy-5-nitro-pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-yl)-6-(cyclohexoxy)-5-nitro-pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-yl)-6-cyclohexyloxy-5-nitro-4-pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-yl)-6-cyclohexyloxy-5-nitropyrimidin-4-amine Traditional Name: 1,3-benzodioxol-5-yl-[6-(cyclohexoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C17H18N4O5 MolecularWeight: 358.34862

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCC(CC1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H18N4O5/c22-21(23)15-16(20-11-6-7-13-14(8-11)25-10-24-13)18-9-19-17(15)26-12-4-2-1-3-5-12/h6-9,12H,1-5,10H2,(H,18,19,20)