N-(2,5-dimethoxyphenyl)-5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-amine

Systemtic Name: N-(2,5-dimethoxyphenyl)-5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-amine Openeye Name: N-(2,5-dimethoxyphenyl)-5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-amine CAS Name: N-(2,5-dimethoxyphenyl)-5-nitro-6-(1-pyrrolidinyl)-4-pyrimidinamine IUPAC Name: N-(2,5-dimethoxyphenyl)-5-nitro-6-pyrrolidin-1-ylpyrimidin-4-amine Traditional Name: (2,5-dimethoxyphenyl)-(5-nitro-6-pyrrolidino-pyrimidin-4-yl)amine Formula: C16H19N5O4 MolecularWeight: 345.35316

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC2=NC=NC(=C2[N+](=O)[O-])N3CCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC2=NC=NC(=C2[N+](=O)[O-])N3CCCC3

InChI

InChI=1S/C16H19N5O4/c1-24-11-5-6-13(25-2)12(9-11)19-15-14(21(22)23)16(18-10-17-15)20-7-3-4-8-20/h5-6,9-10H,3-4,7-8H2,1-2H3,(H,17,18,19)