2-[[2-methyl-1,3-bis(oxidanyl)propan-2-yl]amino]-3,5-dinitro-benzenecarbonitrile

Systemtic Name: 2-[[2-methyl-1,3-bis(oxidanyl)propan-2-yl]amino]-3,5-dinitro-benzenecarbonitrile Openeye Name: 2-[[2-hydroxy-1-(hydroxymethyl)-1-methyl-ethyl]amino]-3,5-dinitro-benzonitrile CAS Name: 2-[(1,3-dihydroxy-2-methylpropan-2-yl)amino]-3,5-dinitrobenzonitrile IUPAC Name: 2-[(1,3-dihydroxy-2-methylpropan-2-yl)amino]-3,5-dinitrobenzonitrile Traditional Name: 2-[(2-hydroxy-1-methyl-1-methylol-ethyl)amino]-3,5-dinitro-benzonitrile Formula: C11H12N4O6 MolecularWeight: 296.23618

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(CO)NC1=C(C=C(C=C1C#N)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(CO)(CO)NC1=C(C=C(C=C1C#N)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H12N4O6/c1-11(5-16,6-17)13-10-7(4-12)2-8(14(18)19)3-9(10)15(20)21/h2-3,13,16-17H,5-6H2,1H3