N-[[4-(2-nitrophenyl)piperazin-1-yl]methyl]pyrimidin-4-amine

Systemtic Name: N-[[4-(2-nitrophenyl)piperazin-1-yl]methyl]pyrimidin-4-amine Openeye Name: N-[[4-(2-nitrophenyl)piperazin-1-yl]methyl]pyrimidin-4-amine CAS Name: N-[[4-(2-nitrophenyl)-1-piperazinyl]methyl]-4-pyrimidinamine IUPAC Name: N-[[4-(2-nitrophenyl)piperazin-1-yl]methyl]pyrimidin-4-amine Traditional Name: [4-(2-nitrophenyl)piperazino]methyl-(4-pyrimidyl)amine Formula: C15H18N6O2 MolecularWeight: 314.34242

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CNC2=NC=NC=C2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CNC2=NC=NC=C2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C15H18N6O2/c22-21(23)14-4-2-1-3-13(14)20-9-7-19(8-10-20)12-18-15-5-6-16-11-17-15/h1-6,11H,7-10,12H2,(H,16,17,18)