4-(2-dimethylaminoethyl)-N-[6-(2-fluoranyl-4-nitro-phenoxy)pyrimidin-4-yl]piperazine-1-carboxamide

Systemtic Name: 4-(2-dimethylaminoethyl)-N-[6-(2-fluoranyl-4-nitro-phenoxy)pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: 4-(2-dimethylaminoethyl)-N-[6-(2-fluoro-4-nitro-phenoxy)pyrimidin-4-yl]piperazine-1-carboxamide CAS Name: 4-(2-dimethylaminoethyl)-N-[6-(2-fluoro-4-nitrophenoxy)-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: 4-(2-dimethylaminoethyl)-N-[6-(2-fluoro-4-nitrophenoxy)pyrimidin-4-yl]piperazine-1-carboxamide Traditional Name: 4-(2-dimethylaminoethyl)-N-[6-(2-fluoro-4-nitro-phenoxy)pyrimidin-4-yl]piperazine-1-carboxamide Formula: C19H24FN7O4 MolecularWeight: 433.436763

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1CCN(CC1)C(=O)NC2=CC(=NC=N2)OC3=C(C=C(C=C3)[N+](=O)[O-])F

Isomeric SMILES

CN(C)CCN1CCN(CC1)C(=O)NC2=CC(=NC=N2)OC3=C(C=C(C=C3)[N+](=O)[O-])F

InChI

InChI=1S/C19H24FN7O4/c1-24(2)5-6-25-7-9-26(10-8-25)19(28)23-17-12-18(22-13-21-17)31-16-4-3-14(27(29)30)11-15(16)20/h3-4,11-13H,5-10H2,1-2H3,(H,21,22,23,28)