5-nitro-N4-phenyl-2-piperidin-1-yl-pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4-phenyl-2-piperidin-1-yl-pyrimidine-4,6-diamine Openeye Name: 5-nitro-N4-phenyl-2-(1-piperidyl)pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-phenyl-2-(1-piperidinyl)pyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N-phenyl-2-piperidin-1-ylpyrimidine-4,6-diamine Traditional Name: (6-amino-5-nitro-2-piperidino-pyrimidin-4-yl)-phenyl-amine Formula: C15H18N6O2 MolecularWeight: 314.34242

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=C(C(=N2)NC3=CC=CC=C3)[N+](=O)[O-])N

Isomeric SMILES

C1CCN(CC1)C2=NC(=C(C(=N2)NC3=CC=CC=C3)[N+](=O)[O-])N

InChI

InChI=1S/C15H18N6O2/c16-13-12(21(22)23)14(17-11-7-3-1-4-8-11)19-15(18-13)20-9-5-2-6-10-20/h1,3-4,7-8H,2,5-6,9-10H2,(H3,16,17,18,19)