N1-(2-azanylethyl)-4,6-dinitro-N3-(2,2,6,6-tetramethyl-1-oxidanyl-piperidin-4-yl)benzene-1,3-diamine

Systemtic Name: N1-(2-azanylethyl)-4,6-dinitro-N3-(2,2,6,6-tetramethyl-1-oxidanyl-piperidin-4-yl)benzene-1,3-diamine Openeye Name: N1-(2-aminoethyl)-N3-(1-hydroxy-2,2,6,6-tetramethyl-4-piperidyl)-4,6-dinitro-benzene-1,3-diamine CAS Name: N1-(2-aminoethyl)-N3-(1-hydroxy-2,2,6,6-tetramethyl-4-piperidinyl)-4,6-dinitrobenzene-1,3-diamine IUPAC Name: 1-N-(2-aminoethyl)-3-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-4,6-dinitrobenzene-1,3-diamine Traditional Name: 2-aminoethyl-[5-[(1-hydroxy-2,2,6,6-tetramethyl-4-piperidyl)amino]-2,4-dinitro-phenyl]amine Formula: C17H28N6O5 MolecularWeight: 396.44142

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(N1O)(C)C)NC2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])NCCN)C

Isomeric SMILES

CC1(CC(CC(N1O)(C)C)NC2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])NCCN)C

InChI

InChI=1S/C17H28N6O5/c1-16(2)9-11(10-17(3,4)23(16)28)20-13-7-12(19-6-5-18)14(21(24)25)8-15(13)22(26)27/h7-8,11,19-20,28H,5-6,9-10,18H2,1-4H3