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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-yl)-5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-yl)-5-nitro-6-(1-pyrrolidinyl)-4-pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-yl)-5-nitro-6-pyrrolidin-1-ylpyrimidin-4-amine Traditional Name: 1,3-benzodioxol-5-yl-(5-nitro-6-pyrrolidino-pyrimidin-4-yl)amine Formula: C15H15N5O4 MolecularWeight: 329.3107

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=NC=N2)NC3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C(=NC=N2)NC3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

InChI

InChI=1S/C15H15N5O4/c21-20(22)13-14(16-8-17-15(13)19-5-1-2-6-19)18-10-3-4-11-12(7-10)24-9-23-11/h3-4,7-8H,1-2,5-6,9H2,(H,16,17,18)