N1,N4-bis(5-nitropyridin-2-yl)cyclohexane-1,4-diamine

Systemtic Name: N1,N4-bis(5-nitropyridin-2-yl)cyclohexane-1,4-diamine Openeye Name: N1,N4-bis(5-nitro-2-pyridyl)cyclohexane-1,4-diamine CAS Name: N1,N4-bis(5-nitro-2-pyridinyl)cyclohexane-1,4-diamine IUPAC Name: 1-N,4-N-bis(5-nitropyridin-2-yl)cyclohexane-1,4-diamine Traditional Name: (5-nitro-2-pyridyl)-[4-[(5-nitro-2-pyridyl)amino]cyclohexyl]amine Formula: C16H18N6O4 MolecularWeight: 358.35192

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC2=NC=C(C=C2)[N+](=O)[O-])NC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC(CCC1NC2=NC=C(C=C2)[N+](=O)[O-])NC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H18N6O4/c23-21(24)13-5-7-15(17-9-13)19-11-1-2-12(4-3-11)20-16-8-6-14(10-18-16)22(25)26/h5-12H,1-4H2,(H,17,19)(H,18,20)