6-(2-ethylpiperidin-1-yl)-5-nitro-N-(3-nitrophenyl)pyrimidin-4-amine

Systemtic Name: 6-(2-ethylpiperidin-1-yl)-5-nitro-N-(3-nitrophenyl)pyrimidin-4-amine Openeye Name: 6-(2-ethyl-1-piperidyl)-5-nitro-N-(3-nitrophenyl)pyrimidin-4-amine CAS Name: 6-(2-ethyl-1-piperidinyl)-5-nitro-N-(3-nitrophenyl)-4-pyrimidinamine IUPAC Name: 6-(2-ethylpiperidin-1-yl)-5-nitro-N-(3-nitrophenyl)pyrimidin-4-amine Traditional Name: [6-(2-ethylpiperidino)-5-nitro-pyrimidin-4-yl]-(3-nitrophenyl)amine Formula: C17H20N6O4 MolecularWeight: 372.3785

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C2=C(C(=NC=N2)NC3=CC(=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC1CCCCN1C2=C(C(=NC=N2)NC3=CC(=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H20N6O4/c1-2-13-7-3-4-9-21(13)17-15(23(26)27)16(18-11-19-17)20-12-6-5-8-14(10-12)22(24)25/h5-6,8,10-11,13H,2-4,7,9H2,1H3,(H,18,19,20)