N6-[2-[[6-(4-ethylphenyl)-5-nitro-pyridin-2-yl]amino]ethyl]-3-nitro-pyridine-2,6-diamine

Systemtic Name: N6-[2-[[6-(4-ethylphenyl)-5-nitro-pyridin-2-yl]amino]ethyl]-3-nitro-pyridine-2,6-diamine Openeye Name: N6-[2-[[6-(4-ethylphenyl)-5-nitro-2-pyridyl]amino]ethyl]-3-nitro-pyridine-2,6-diamine CAS Name: N6-[2-[[6-(4-ethylphenyl)-5-nitro-2-pyridinyl]amino]ethyl]-3-nitropyridine-2,6-diamine IUPAC Name: 6-N-[2-[[6-(4-ethylphenyl)-5-nitropyridin-2-yl]amino]ethyl]-3-nitropyridine-2,6-diamine Traditional Name: (6-amino-5-nitro-2-pyridyl)-[2-[[6-(4-ethylphenyl)-5-nitro-2-pyridyl]amino]ethyl]amine Formula: C20H21N7O4 MolecularWeight: 423.42524

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(C=CC(=N2)NCCNC3=NC(=C(C=C3)[N+](=O)[O-])N)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(C=CC(=N2)NCCNC3=NC(=C(C=C3)[N+](=O)[O-])N)[N+](=O)[O-]

InChI

InChI=1S/C20H21N7O4/c1-2-13-3-5-14(6-4-13)19-15(26(28)29)7-9-17(24-19)22-11-12-23-18-10-8-16(27(30)31)20(21)25-18/h3-10H,2,11-12H2,1H3,(H,22,24)(H3,21,23,25)